N-(3-methylbutylcarbamoyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-methylbutylcarbamoyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(isopentylcarbamoyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(3-methylbutylamino)-oxomethyl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(3-methylbutylcarbamoyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(isoamylcarbamoyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C16H21N5O2S MolecularWeight: 347.43524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)CSC1=NNC(=N1)C2=CC=CC=C2

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)CSC1=NNC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C16H21N5O2S/c1-11(2)8-9-17-15(23)18-13(22)10-24-16-19-14(20-21-16)12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H,19,20,21)(H2,17,18,22,23)