2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-ethylphenyl)propanamide

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-ethylphenyl)propanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-ethylphenyl)propanamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(4-ethylphenyl)propanamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-ethylphenyl)propanamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(4-ethylphenyl)propionamide Formula: C13H17N5OS MolecularWeight: 291.37198

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)SC2=NNC(=N2)N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(C)SC2=NNC(=N2)N

InChI

InChI=1S/C13H17N5OS/c1-3-9-4-6-10(7-5-9)15-11(19)8(2)20-13-16-12(14)17-18-13/h4-8H,3H2,1-2H3,(H,15,19)(H3,14,16,17,18)