4-cyclopropyl-2-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-5-pyridin-3-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-cyclopropyl-2-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-5-pyridin-3-yl-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-2-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-5-(3-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-2-[[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]methyl]-5-(3-pyridinyl)-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-2-[[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]methyl]-5-pyridin-3-yl-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-2-[[(4-ethoxy-3-methoxy-benzyl)-methyl-amino]methyl]-5-(3-pyridyl)-1,2,4-triazole-3-thione Formula: C22H27N5O2S MolecularWeight: 425.54708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN(C)CN2C(=S)N(C(=N2)C3=CN=CC=C3)C4CC4)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN(C)CN2C(=S)N(C(=N2)C3=CN=CC=C3)C4CC4)OC

InChI

InChI=1S/C22H27N5O2S/c1-4-29-19-10-7-16(12-20(19)28-3)14-25(2)15-26-22(30)27(18-8-9-18)21(24-26)17-6-5-11-23-13-17/h5-7,10-13,18H,4,8-9,14-15H2,1-3H3