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

Systemtic Name: 4-cyclopropyl-2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-5-thiophen-2-yl-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-5-(2-thienyl)-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-2-[[4-(2,3-dimethylphenyl)-1-piperazinyl]methyl]-5-thiophen-2-yl-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-5-thiophen-2-yl-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-2-[[4-(2,3-dimethylphenyl)piperazino]methyl]-5-(2-thienyl)-1,2,4-triazole-3-thione Formula: C22H27N5S2 MolecularWeight: 425.61328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)CN3C(=S)N(C(=N3)C4=CC=CS4)C5CC5)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)CN3C(=S)N(C(=N3)C4=CC=CS4)C5CC5)C

InChI

InChI=1S/C22H27N5S2/c1-16-5-3-6-19(17(16)2)25-12-10-24(11-13-25)15-26-22(28)27(18-8-9-18)21(23-26)20-7-4-14-29-20/h3-7,14,18H,8-13,15H2,1-2H3