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

Systemtic Name: 2-[[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]methyl]-5-methyl-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-2-[[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]methyl]-5-methyl-1,2,4-triazole-3-thione CAS Name: 2-[[4-[(2-methoxy-5-methylphenyl)methyl]-1-piperazinyl]methyl]-5-methyl-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[4-[(2-methoxy-5-methylphenyl)methyl]piperazin-1-yl]methyl]-5-methyl-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-2-[[4-(2-methoxy-5-methyl-benzyl)piperazino]methyl]-5-methyl-1,2,4-triazole-3-thione Formula: C20H29N5OS MolecularWeight: 387.54216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29N5OS/c1-5-8-24-17(3)21-25(20(24)27)15-23-11-9-22(10-12-23)14-18-13-16(2)6-7-19(18)26-4/h5-7,13H,1,8-12,14-15H2,2-4H3