PIRITREXIM ISETHIONATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H19N5O2.C2H6O4S
Molecular Weight	451.497
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OCCS(O)(=O)=O.COC1=CC(CC2=C(C)C3=C(N=C2)N=C(N)N=C3N)=C(OC)C=C1

InChI

InChIKey=IOEMETRLOWNXGW-UHFFFAOYSA-N

InChI=1S/C17H19N5O2.C2H6O4S/c1-9-11(6-10-7-12(23-2)4-5-13(10)24-3)8-20-16-14(9)15(18)21-17(19)22-16;3-1-2-7(4,5)6/h4-5,7-8H,6H2,1-3H3,(H4,18,19,20,21,22);3H,1-2H2,(H,4,5,6)

HIDE SMILES / InChI

Molecular Formula	C2H6O4S
Molecular Weight	126.132
Charge	0
Count

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

Molecular Formula	C17H19N5O2
Molecular Weight	325.3651
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 `Fri Dec 15 18:37:20 UTC 2023` Edited by `admin` on `Fri Dec 15 18:37:20 UTC 2023`
Record UNII	V77I71FH72
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PIRITREXIM ISETHIONATE

Official Name

English

PYRIDO(2,3-D)PYRIMIDINE-2,4-DIAMINE, 6-((2,5-DIMETHOXYPHENYL)METHYL)-5-METHYL-, MONO(2-HYDROXYETHANESULPHONATE)

Common Name

English

PYRIDO(2,3-D)PYRIMIDINE-2,4-DIAMINE, 6-((2,5-DIMETHOXYPHENYL)METHYL)-5-METHYL-, MONO(2-HYDROXYETHANESULFONATE)

Common Name

English

PIRITREXIM ISETHIONATE [USAN]

Common Name

English

Piritrexim isethionate [WHO-DD]

Common Name

English

2,4-Diamino-6-(2,5-dimethoxybenzyl)-5-methylpyrido[2,3-d]pyrimidine mono(2-hydroxyethanesulfonate)

Systematic Name

English

BW-301U ISETHIONATE

Code

English

PIRITREXIM ISETHIONATE [MI]

Common Name

English

2,4-DIAMINO-6-(2,5-DIMETHOXYBENZYL)-5-METHYLPYRIDO(2,3-D)PYRIMIDINE MONO(2-HYDROXYETHANESULPHONATE)

Systematic Name

English

BW 301U ISETHIONATE

Code

English

NSC-351521

Code

English

PIRITREXIM ISETIONATE [MART.]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C511