2-[[2-(4-chloranylphenoxy)ethyl-methyl-amino]methyl]-4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[2-(4-chloranylphenoxy)ethyl-methyl-amino]methyl]-4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[2-(4-chlorophenoxy)ethyl-methyl-amino]methyl]-4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[[2-(4-chlorophenoxy)ethyl-methylamino]methyl]-4-cyclopropyl-5-(3-pyridinyl)-1,2,4-triazole-3-thione IUPAC Name: 2-[[2-(4-chlorophenoxy)ethyl-methylamino]methyl]-4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[2-(4-chlorophenoxy)ethyl-methyl-amino]methyl]-4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazole-3-thione Formula: C20H22ClN5OS MolecularWeight: 415.93958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN5OS/c1-24(11-12-27-18-8-4-16(21)5-9-18)14-25-20(28)26(17-6-7-17)19(23-25)15-3-2-10-22-13-15/h2-5,8-10,13,17H,6-7,11-12,14H2,1H3