CIMETIDINE HYDROXYMETHYL

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H16N6OS
Molecular Weight	268.3401
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN=C(NCCSCc1c(CO)nc[nH]1)NC#N

InChI

InChIKey=JSTWNRREBFKXNZ-UHFFFAOYSA-N

InChI=1S/C10H16N6OS/c1-12-10(14-6-11)13-2-3-18-5-9-8(4-17)15-7-16-9/h7,17H,2-5H2,1H3,(H,15,16)(H2,12,13,14)

HIDE SMILES / InChI

Molecular Formula	C10H16N6OS
Molecular Weight	268.3401
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 Jun 26 10:09:49 UTC 2021` Edited by `admin` on `Sat Jun 26 10:09:49 UTC 2021`
Record UNII	1I301OP4HL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CIMETIDINE HYDROXYMETHYL

Common Name

English

(N-METHYL-N'-CYANO-N''-(2-((5-HYDROXYMETHYLIMIDAZOL-4-YL)METHYLTHIO)ETHYL)GUANIDINE

Systematic Name

English

N-CYANO-N'-(2-(((4-(HYDROXYMETHYL)-1H-IMIDAZOL-5-YL)METHYL)THIO)ETHYL)-N''-METHYLGUANIDINE

Systematic Name

English

GUANIDINE, N-CYANO-N'-(2-(((4-(HYDROXYMETHYL)-1H-IMIDAZOL-5-YL)METHYL)THIO)ETHYL)-N''-METHYL-

Systematic Name

English

Code System Code Type Description

EPA CompTox

59359-50-1

Created by admin on Sat Jun 26 10:09:49 UTC 2021 , Edited by admin on Sat Jun 26 10:09:49 UTC 2021

PRIMARY

PUBCHEM

162879

Created by admin on Sat Jun 26 10:09:49 UTC 2021 , Edited by admin on Sat Jun 26 10:09:49 UTC 2021

PRIMARY

CAS

59359-50-1

Created by admin on Sat Jun 26 10:09:49 UTC 2021 , Edited by admin on Sat Jun 26 10:09:49 UTC 2021

PRIMARY

FDA UNII

1I301OP4HL

Created by admin on Sat Jun 26 10:09:49 UTC 2021 , Edited by admin on Sat Jun 26 10:09:49 UTC 2021

PRIMARY

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CIMETIDINE

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