SODIUM 6-(3-P-CHLOROPHENYL-5-METHYLISOTHIAZOLYL-4-CARBOXAMIDO) PENICILLANATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H17ClN3O4S2.Na
Molecular Weight	473.929
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SODIUM 6-(3-P-CHLOROPHENYL-5-METHYLISOTHIAZOLYL-4-CARBOXAMIDO) PENICILLANATE

Structure Search

SMILES

[Na+].[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)C3=C(C)SN=C3C4=CC=C(Cl)C=C4)C([O-])=O

InChI

InChIKey=SVICHKYFVZWTPA-SLINCCQESA-M

InChI=1S/C19H18ClN3O4S2.Na/c1-8-11(12(22-29-8)9-4-6-10(20)7-5-9)15(24)21-13-16(25)23-14(18(26)27)19(2,3)28-17(13)23;/h4-7,13-14,17H,1-3H3,(H,21,24)(H,26,27);/q;+1/p-1/t13-,14+,17-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C19H17ClN3O4S2
Molecular Weight	450.939
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:24:09 UTC 2023` Edited by `admin` on `Fri Dec 15 15:24:09 UTC 2023`
Record UNII	3PLT9EUB31
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SODIUM 6-(3-P-CHLOROPHENYL-5-METHYLISOTHIAZOLYL-4-CARBOXAMIDO) PENICILLANATE

Common Name

English

SODIUM 6-(3-P-CHLOROPHENYL-5-METHYL-ISOTHIAZOLE-4-CARBOXAMIDO)PENICILLINATE

Common Name

English

4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 6-(3-(P-CHLOROPHENYL)-5-METHYL-4-ISOTHIAZOLECARBOXAMIDO)-3,3-DIMETHYL-7-OXO-, MONOSODIUM SALT

Systematic Name

English

Code System Code Type Description

FDA UNII

3PLT9EUB31

Created by admin on Fri Dec 15 15:24:09 UTC 2023 , Edited by admin on Fri Dec 15 15:24:09 UTC 2023

PRIMARY

PUBCHEM

133082722

Created by admin on Fri Dec 15 15:24:09 UTC 2023 , Edited by admin on Fri Dec 15 15:24:09 UTC 2023

PRIMARY

CAS

16188-04-8

Created by admin on Fri Dec 15 15:24:09 UTC 2023 , Edited by admin on Fri Dec 15 15:24:09 UTC 2023

PRIMARY

Related Record Type Details


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6-(3-P-CHLOROPHENYL-5-METHYLISOTHIAZOLYL-4-CARBOXAMIDO)PENICILLIN

PARENT -> SALT/SOLVATE

Amount: