N-[1-[4-(2,4-dichlorophenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[1-[4-(2,4-dichlorophenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-2,6-dimethoxy-benzamide Openeye Name: N-[1-[4-(2,4-dichlorophenyl)-5-(m-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-2,6-dimethoxy-benzamide CAS Name: N-[1-[4-(2,4-dichlorophenyl)-5-[(3-methylphenyl)methylthio]-1,2,4-triazol-3-yl]-2-phenylethyl]-2,6-dimethoxybenzamide IUPAC Name: N-[1-[4-(2,4-dichlorophenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-2-phenylethyl]-2,6-dimethoxybenzamide Traditional Name: N-[1-[4-(2,4-dichlorophenyl)-5-[(3-methylbenzyl)thio]-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-2,6-dimethoxy-benzamide Formula: C33H30Cl2N4O3S MolecularWeight: 633.5873

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2C3=C(C=C(C=C3)Cl)Cl)C(CC4=CC=CC=C4)NC(=O)C5=C(C=CC=C5OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2C3=C(C=C(C=C3)Cl)Cl)C(CC4=CC=CC=C4)NC(=O)C5=C(C=CC=C5OC)OC

InChI

InChI=1S/C33H30Cl2N4O3S/c1-21-9-7-12-23(17-21)20-43-33-38-37-31(39(33)27-16-15-24(34)19-25(27)35)26(18-22-10-5-4-6-11-22)36-32(40)30-28(41-2)13-8-14-29(30)42-3/h4-17,19,26H,18,20H2,1-3H3,(H,36,40)