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

Systemtic Name: 2-(3-methylsulfanylphenoxy)-N-[4-(pyridin-2-ylcarbonylamino)cyclohexyl]pyridine-3-carboxamide Openeye Name: 2-(3-methylsulfanylphenoxy)-N-[4-(pyridine-2-carbonylamino)cyclohexyl]pyridine-3-carboxamide CAS Name: 2-[3-(methylthio)phenoxy]-N-[4-[[oxo(2-pyridinyl)methyl]amino]cyclohexyl]-3-pyridinecarboxamide IUPAC Name: 2-(3-methylsulfanylphenoxy)-N-[4-(pyridine-2-carbonylamino)cyclohexyl]pyridine-3-carboxamide Traditional Name: 2-[3-(methylthio)phenoxy]-N-(4-picolinamidocyclohexyl)nicotinamide Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3CCC(CC3)NC(=O)C4=CC=CC=N4

Isomeric SMILES

CSC1=CC=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3CCC(CC3)NC(=O)C4=CC=CC=N4

InChI

InChI=1S/C25H26N4O3S/c1-33-20-7-4-6-19(16-20)32-25-21(8-5-15-27-25)23(30)28-17-10-12-18(13-11-17)29-24(31)22-9-2-3-14-26-22/h2-9,14-18H,10-13H2,1H3,(H,28,30)(H,29,31)