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

Systemtic Name: 2-[[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]methyl]-4-methyl-5-phenyl-1,2,4-triazole-3-thione Openeye Name: 2-[[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]methyl]-4-methyl-5-phenyl-1,2,4-triazole-3-thione CAS Name: 2-[[4-[(2-methoxy-5-methylphenyl)methyl]-1-piperazinyl]methyl]-4-methyl-5-phenyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[4-[(2-methoxy-5-methylphenyl)methyl]piperazin-1-yl]methyl]-4-methyl-5-phenyl-1,2,4-triazole-3-thione Traditional Name: 2-[[4-(2-methoxy-5-methyl-benzyl)piperazino]methyl]-4-methyl-5-phenyl-1,2,4-triazole-3-thione Formula: C23H29N5OS MolecularWeight: 423.57426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN2CCN(CC2)CN3C(=S)N(C(=N3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN2CCN(CC2)CN3C(=S)N(C(=N3)C4=CC=CC=C4)C

InChI

InChI=1S/C23H29N5OS/c1-18-9-10-21(29-3)20(15-18)16-26-11-13-27(14-12-26)17-28-23(30)25(2)22(24-28)19-7-5-4-6-8-19/h4-10,15H,11-14,16-17H2,1-3H3