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

Systemtic Name: 2-[[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione Openeye Name: 2-[[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione CAS Name: 2-[[4-[(2-methoxy-5-methylphenyl)methyl]-1-piperazinyl]methyl]-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[4-[(2-methoxy-5-methylphenyl)methyl]piperazin-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione Traditional Name: 2-[[4-(2-methoxy-5-methyl-benzyl)piperazino]methyl]-4-methyl-1,2,4-triazole-3-thione Formula: C17H25N5OS MolecularWeight: 347.4783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N5OS/c1-14-4-5-16(23-3)15(10-14)11-20-6-8-21(9-7-20)13-22-17(24)19(2)12-18-22/h4-5,10,12H,6-9,11,13H2,1-3H3