2-(4-methylsulfanylphenoxy)-N-[4-(pyridin-2-ylmethylcarbamoyl)cyclohexyl]pyridine-3-carboxamide

Systemtic Name: 2-(4-methylsulfanylphenoxy)-N-[4-(pyridin-2-ylmethylcarbamoyl)cyclohexyl]pyridine-3-carboxamide Openeye Name: 2-(4-methylsulfanylphenoxy)-N-[4-(2-pyridylmethylcarbamoyl)cyclohexyl]pyridine-3-carboxamide CAS Name: 2-[4-(methylthio)phenoxy]-N-[4-[oxo-(2-pyridinylmethylamino)methyl]cyclohexyl]-3-pyridinecarboxamide IUPAC Name: 2-(4-methylsulfanylphenoxy)-N-[4-(pyridin-2-ylmethylcarbamoyl)cyclohexyl]pyridine-3-carboxamide Traditional Name: 2-[4-(methylthio)phenoxy]-N-[4-(2-pyridylmethylcarbamoyl)cyclohexyl]nicotinamide Formula: C26H28N4O3S MolecularWeight: 476.59052

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)NC3CCC(CC3)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

CSC1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)NC3CCC(CC3)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C26H28N4O3S/c1-34-22-13-11-21(12-14-22)33-26-23(6-4-16-28-26)25(32)30-19-9-7-18(8-10-19)24(31)29-17-20-5-2-3-15-27-20/h2-6,11-16,18-19H,7-10,17H2,1H3,(H,29,31)(H,30,32)