2-[[4-(3-chlorophenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-(diphenylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[4-(3-chlorophenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-(diphenylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: N-benzhydryl-2-[[5-benzyl-4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazole-4-carboxamide CAS Name: 2-[[[4-(3-chlorophenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-N-(diphenylmethyl)-4-thiazolecarboxamide IUPAC Name: N-benzhydryl-2-[[5-benzyl-4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-benzhydryl-2-[[[5-benzyl-4-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole-4-carboxamide Formula: C33H26ClN5OS2 MolecularWeight: 608.17544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(N2C3=CC(=CC=C3)Cl)SCC4=NC(=CS4)C(=O)NC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(N2C3=CC(=CC=C3)Cl)SCC4=NC(=CS4)C(=O)NC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C33H26ClN5OS2/c34-26-17-10-18-27(20-26)39-29(19-23-11-4-1-5-12-23)37-38-33(39)42-22-30-35-28(21-41-30)32(40)36-31(24-13-6-2-7-14-24)25-15-8-3-9-16-25/h1-18,20-21,31H,19,22H2,(H,36,40)