OXATOMIDE MONOHYDRATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H30N4O.H2O
Molecular Weight	444.5686
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O.O=C1NC2=CC=CC=C2N1CCCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChIKey=WUVRHFANMRXNRX-UHFFFAOYSA-N

InChI=1S/C27H30N4O.H2O/c32-27-28-24-14-7-8-15-25(24)31(27)17-9-16-29-18-20-30(21-19-29)26(22-10-3-1-4-11-22)23-12-5-2-6-13-23;/h1-8,10-15,26H,9,16-21H2,(H,28,32);1H2

HIDE SMILES / InChI

Molecular Formula	C27H30N4O
Molecular Weight	426.5533
Charge	0
Count

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

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
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 `Sat Dec 16 10:09:07 UTC 2023` Edited by `admin` on `Sat Dec 16 10:09:07 UTC 2023`
Record UNII	AH84KRJ5KM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

OXATOMIDE MONOHYDRATE

Common Name

English

2H-BENZIMIDAZOL-2-ONE, 1-(3-(4-(DIPHENYLMETHYL)-1-PIPERAZINYL)PROPYL)-1,3-DIHYDRO-, HYDRATE (1:1)

Systematic Name

English

2H-BENZIMIDAZOL-2-ONE, 1-(3-(4-(DIPHENYLMETHYL)-1-PIPERAZINYL)PROPYL)-1,3-DIHYDRO-, MONOHYDRATE

Systematic Name

English

Code System Code Type Description

SMS_ID

100000130699