2-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 2-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 2-[(4-benzhydrylpiperazin-1-yl)methyl]-4-phenethyl-5-(2-thienylmethyl)-1,2,4-triazole-3-thione CAS Name: 2-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 2-[(4-benzhydrylpiperazin-1-yl)methyl]-4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 2-[(4-benzhydrylpiperazino)methyl]-4-phenethyl-5-(2-thenyl)-1,2,4-triazole-3-thione Formula: C33H35N5S2 MolecularWeight: 565.7945

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=S)N(C(=N2)CC3=CC=CS3)CCC4=CC=CC=C4)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CN2C(=S)N(C(=N2)CC3=CC=CS3)CCC4=CC=CC=C4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C33H35N5S2/c39-33-37(19-18-27-11-4-1-5-12-27)31(25-30-17-10-24-40-30)34-38(33)26-35-20-22-36(23-21-35)32(28-13-6-2-7-14-28)29-15-8-3-9-16-29/h1-17,24,32H,18-23,25-26H2