2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(3-cyano-4,5-dimethyl-thiophen-2-yl)propanamide

Systemtic Name: 2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(3-cyano-4,5-dimethyl-thiophen-2-yl)propanamide Openeye Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(3-cyano-4,5-dimethyl-2-thienyl)propanamide CAS Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-(3-cyano-4,5-dimethyl-2-thiophenyl)propanamide IUPAC Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(3-cyano-4,5-dimethylthiophen-2-yl)propanamide Traditional Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-(3-cyano-4,5-dimethyl-2-thienyl)propionamide Formula: C13H16N6OS2 MolecularWeight: 336.43574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C(C)N2C(=NN=C2SC)N)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C(C)N2C(=NN=C2SC)N)C

InChI

InChI=1S/C13H16N6OS2/c1-6-8(3)22-11(9(6)5-14)16-10(20)7(2)19-12(15)17-18-13(19)21-4/h7H,1-4H3,(H2,15,17)(H,16,20)