N-(diphenylmethyl)-4-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide

Systemtic Name: N-(diphenylmethyl)-4-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide Openeye Name: N-benzhydryl-4-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide CAS Name: N-(diphenylmethyl)-4-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]butanamide IUPAC Name: N-benzhydryl-4-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide Traditional Name: N-benzhydryl-4-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]butyramide Formula: C32H30N4O2S MolecularWeight: 534.6712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SCCCC(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SCCCC(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H30N4O2S/c1-38-28-21-19-27(20-22-28)36-31(26-16-9-4-10-17-26)34-35-32(36)39-23-11-18-29(37)33-30(24-12-5-2-6-13-24)25-14-7-3-8-15-25/h2-10,12-17,19-22,30H,11,18,23H2,1H3,(H,33,37)