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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)CSC1=NN=CN1C2=CC=CC=C2

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)CSC1=NN=CN1C2=CC=CC=C2

InChI

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