2-[[5-cyclopropyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)-3-methyl-butanamide

Systemtic Name: 2-[[5-cyclopropyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)-3-methyl-butanamide Openeye Name: 2-[(4-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)-3-methyl-butanamide CAS Name: 2-[[5-cyclopropyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N-(4-methoxyphenyl)-3-methylbutanamide IUPAC Name: 2-[(4-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)-3-methylbutanamide Traditional Name: 2-[(4-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-(4-methoxyphenyl)-3-methyl-butyramide Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)OC)SC2=NN=C(N2CC3=CC=CC=C3)C4CC4

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=C(C=C1)OC)SC2=NN=C(N2CC3=CC=CC=C3)C4CC4

InChI

InChI=1S/C24H28N4O2S/c1-16(2)21(23(29)25-19-11-13-20(30-3)14-12-19)31-24-27-26-22(18-9-10-18)28(24)15-17-7-5-4-6-8-17/h4-8,11-14,16,18,21H,9-10,15H2,1-3H3,(H,25,29)