2-chloranyl-5-[(4-cyclohexyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]pyridine

Systemtic Name: 2-chloranyl-5-[(4-cyclohexyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]pyridine Openeye Name: 2-chloro-5-[[4-cyclohexyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine CAS Name: 2-chloro-5-[[[4-cyclohexyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]pyridine IUPAC Name: 2-chloro-5-[(4-cyclohexyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]pyridine Traditional Name: 2-chloro-5-[[[4-cyclohexyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]pyridine Formula: C19H20ClN5S MolecularWeight: 385.9136

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCC3=CN=C(C=C3)Cl)C4=CN=CC=C4

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCC3=CN=C(C=C3)Cl)C4=CN=CC=C4

InChI

InChI=1S/C19H20ClN5S/c20-17-9-8-14(11-22-17)13-26-19-24-23-18(15-5-4-10-21-12-15)25(19)16-6-2-1-3-7-16/h4-5,8-12,16H,1-3,6-7,13H2