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

Systemtic Name: N-(phenylmethyl)-2-[(5-propan-2-yl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-benzyl-acetamide CAS Name: N-(phenylmethyl)-2-[(5-propan-2-yl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-benzyl-2-[(5-propan-2-yl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-5-isopropyl-1,2,4-triazol-3-yl)thio]-N-benzyl-acetamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1CC=C)SCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)C1=NN=C(N1CC=C)SCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C17H22N4OS/c1-4-10-21-16(13(2)3)19-20-17(21)23-12-15(22)18-11-14-8-6-5-7-9-14/h4-9,13H,1,10-12H2,2-3H3,(H,18,22)