[2-[[5-(2-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]-[4-(diphenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [2-[[5-(2-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]-[4-(diphenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzhydrylpiperazin-1-yl)-[2-[[5-(2-chlorophenyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazol-4-yl]methanone CAS Name: [2-[[[5-(2-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-4-thiazolyl]-[4-(diphenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzhydrylpiperazin-1-yl)-[2-[[5-(2-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]methanone Traditional Name: (4-benzhydrylpiperazino)-[2-[[[5-(2-chlorophenyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]methyl]thiazol-4-yl]methanone Formula: C37H33ClN6OS2 MolecularWeight: 677.28052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=NC(=CS3)C(=O)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=NC(=CS3)C(=O)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7Cl

InChI

InChI=1S/C37H33ClN6OS2/c1-26-16-18-29(19-17-26)44-35(30-14-8-9-15-31(30)38)40-41-37(44)47-25-33-39-32(24-46-33)36(45)43-22-20-42(21-23-43)34(27-10-4-2-5-11-27)28-12-6-3-7-13-28/h2-19,24,34H,20-23,25H2,1H3