2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]ethanamide

Systemtic Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]ethanamide Openeye Name: N-[(4-benzyloxy-3-methoxy-phenyl)methyl]-2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide IUPAC Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide Traditional Name: N-(4-benzoxy-3-methoxy-benzyl)-2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=O)CSC2=NNC(=N2)C3CC3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=O)CSC2=NNC(=N2)C3CC3)OCC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3S/c1-28-19-11-16(7-10-18(19)29-13-15-5-3-2-4-6-15)12-23-20(27)14-30-22-24-21(25-26-22)17-8-9-17/h2-7,10-11,17H,8-9,12-14H2,1H3,(H,23,27)(H,24,25,26)