2-[[(4-chlorophenyl)methyl-methyl-amino]methyl]-4-(furan-2-ylmethyl)-5-pyridin-3-yl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[(4-chlorophenyl)methyl-methyl-amino]methyl]-4-(furan-2-ylmethyl)-5-pyridin-3-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[(4-chlorophenyl)methyl-methyl-amino]methyl]-4-(2-furylmethyl)-5-(3-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[[(4-chlorophenyl)methyl-methylamino]methyl]-4-(2-furanylmethyl)-5-(3-pyridinyl)-1,2,4-triazole-3-thione IUPAC Name: 2-[[(4-chlorophenyl)methyl-methylamino]methyl]-4-(furan-2-ylmethyl)-5-pyridin-3-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[(4-chlorobenzyl)-methyl-amino]methyl]-4-(2-furfuryl)-5-(3-pyridyl)-1,2,4-triazole-3-thione Formula: C21H20ClN5OS MolecularWeight: 425.9344

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)Cl)CN2C(=S)N(C(=N2)C3=CN=CC=C3)CC4=CC=CO4

Isomeric SMILES

CN(CC1=CC=C(C=C1)Cl)CN2C(=S)N(C(=N2)C3=CN=CC=C3)CC4=CC=CO4

InChI

InChI=1S/C21H20ClN5OS/c1-25(13-16-6-8-18(22)9-7-16)15-27-21(29)26(14-19-5-3-11-28-19)20(24-27)17-4-2-10-23-12-17/h2-12H,13-15H2,1H3