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

Systemtic Name: N-(phenylmethyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-propan-2-yl-ethanamide Openeye Name: N-benzyl-N-isopropyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(phenylmethyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-propan-2-ylacetamide IUPAC Name: N-benzyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-propan-2-ylacetamide Traditional Name: N-benzyl-N-isopropyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C(=O)CSC2=NNC(=N2)C3=CC=CC=C3

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C(=O)CSC2=NNC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4OS/c1-15(2)24(13-16-9-5-3-6-10-16)18(25)14-26-20-21-19(22-23-20)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3,(H,21,22,23)