5-cyclopropyl-2-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-4-ethyl-1,2,4-triazole-3-thione

Systemtic Name: 5-cyclopropyl-2-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-4-ethyl-1,2,4-triazole-3-thione Openeye Name: 2-[(4-benzhydrylpiperazin-1-yl)methyl]-5-cyclopropyl-4-ethyl-1,2,4-triazole-3-thione CAS Name: 5-cyclopropyl-2-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-4-ethyl-1,2,4-triazole-3-thione IUPAC Name: 2-[(4-benzhydrylpiperazin-1-yl)methyl]-5-cyclopropyl-4-ethyl-1,2,4-triazole-3-thione Traditional Name: 2-[(4-benzhydrylpiperazino)methyl]-5-cyclopropyl-4-ethyl-1,2,4-triazole-3-thione Formula: C25H31N5S MolecularWeight: 433.61214

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5CC5

Isomeric SMILES

CCN1C(=NN(C1=S)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C25H31N5S/c1-2-29-24(22-13-14-22)26-30(25(29)31)19-27-15-17-28(18-16-27)23(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,22-23H,2,13-19H2,1H3