ethyl 6-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]pyridine-3-carboxylate Openeye Name: ethyl 6-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]pyridine-3-carboxylate CAS Name: 6-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]pyridine-3-carboxylate Traditional Name: 6-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]nicotinic acid ethyl ester Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)SC2=NN=C(N2C3CCCCC3)C

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)SC2=NN=C(N2C3CCCCC3)C

InChI

InChI=1S/C17H22N4O2S/c1-3-23-16(22)13-9-10-15(18-11-13)24-17-20-19-12(2)21(17)14-7-5-4-6-8-14/h9-11,14H,3-8H2,1-2H3