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

Systemtic Name: 5-cyclopropyl-2-[[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione Openeye Name: 5-cyclopropyl-2-[[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione CAS Name: 5-cyclopropyl-2-[[4-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-piperazinyl]methyl]-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 5-cyclopropyl-2-[[4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazin-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione Traditional Name: 5-cyclopropyl-2-[[4-(4,5-dimethoxy-2-methyl-benzyl)piperazino]methyl]-4-methyl-1,2,4-triazole-3-thione Formula: C21H31N5O2S MolecularWeight: 417.56814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CCN(CC2)CN3C(=S)N(C(=N3)C4CC4)C)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CCN(CC2)CN3C(=S)N(C(=N3)C4CC4)C)OC)OC

InChI

InChI=1S/C21H31N5O2S/c1-15-11-18(27-3)19(28-4)12-17(15)13-24-7-9-25(10-8-24)14-26-21(29)23(2)20(22-26)16-5-6-16/h11-12,16H,5-10,13-14H2,1-4H3