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Details

Stereochemistry ACHIRAL
Molecular Formula C17H13N3S
Molecular Weight 291.37
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of METHYL N-CYANO-N'-(9-PHENANTHRYL)IMIDOTHIOCARBAMATE

SMILES

CS\C(NC#N)=N/C1=C2C=CC=CC2=C3C=CC=CC3=C1

InChI

InChIKey=XFOPLQJPKWQWRL-UHFFFAOYSA-N
InChI=1S/C17H13N3S/c1-21-17(19-11-18)20-16-10-12-6-2-3-7-13(12)14-8-4-5-9-15(14)16/h2-10H,1H3,(H,19,20)

HIDE SMILES / InChI

Molecular Formula C17H13N3S
Molecular Weight 291.37
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:44:22 GMT 2023
Edited
by admin
on Sat Dec 16 12:44:22 GMT 2023
Record UNII
2O66V4Y1LL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL N-CYANO-N'-(9-PHENANTHRYL)IMIDOTHIOCARBAMATE
Common Name English
NSC-34756
Code English
CARBAMIMIDOTHIOIC ACID, N-CYANO-N'-9-PHENANTHRENYL-, METHYL ESTER
Systematic Name English
Code System Code Type Description
PUBCHEM
234592
Created by admin on Sat Dec 16 12:44:22 GMT 2023 , Edited by admin on Sat Dec 16 12:44:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID70211843
Created by admin on Sat Dec 16 12:44:22 GMT 2023 , Edited by admin on Sat Dec 16 12:44:22 GMT 2023
PRIMARY
CAS
6278-34-8
Created by admin on Sat Dec 16 12:44:22 GMT 2023 , Edited by admin on Sat Dec 16 12:44:22 GMT 2023
PRIMARY
FDA UNII
2O66V4Y1LL
Created by admin on Sat Dec 16 12:44:22 GMT 2023 , Edited by admin on Sat Dec 16 12:44:22 GMT 2023
PRIMARY
NSC
34756
Created by admin on Sat Dec 16 12:44:22 GMT 2023 , Edited by admin on Sat Dec 16 12:44:22 GMT 2023
PRIMARY