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

Systemtic Name: 2-[[5-(diphenylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[(4-allyl-5-benzhydryl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide CAS Name: 2-[[5-(diphenylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[(5-benzhydryl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[(4-allyl-5-benzhydryl-1,2,4-triazol-3-yl)thio]-N-(4-methoxyphenyl)acetamide Formula: C27H26N4O2S MolecularWeight: 470.58594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O2S/c1-3-18-31-26(25(20-10-6-4-7-11-20)21-12-8-5-9-13-21)29-30-27(31)34-19-24(32)28-22-14-16-23(33-2)17-15-22/h3-17,25H,1,18-19H2,2H3,(H,28,32)