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

Systemtic Name: 4-ethyl-2-[[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]methyl]-1,2,4-triazole-3-thione Openeye Name: 4-ethyl-2-[[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-ethyl-2-[[4-[(2-methoxy-5-methylphenyl)methyl]-1-piperazinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-ethyl-2-[[4-[(2-methoxy-5-methylphenyl)methyl]piperazin-1-yl]methyl]-1,2,4-triazole-3-thione Traditional Name: 4-ethyl-2-[[4-(2-methoxy-5-methyl-benzyl)piperazino]methyl]-1,2,4-triazole-3-thione Formula: C18H27N5OS MolecularWeight: 361.50488

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN(C1=S)CN2CCN(CC2)CC3=C(C=CC(=C3)C)OC

Isomeric SMILES

CCN1C=NN(C1=S)CN2CCN(CC2)CC3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C18H27N5OS/c1-4-22-13-19-23(18(22)25)14-21-9-7-20(8-10-21)12-16-11-15(2)5-6-17(16)24-3/h5-6,11,13H,4,7-10,12,14H2,1-3H3