N-[4-[3-(4-chlorophenyl)sulfanylpropanoylamino]-2-methoxy-phenyl]pyridine-3-carboxamide

Systemtic Name: N-[4-[3-(4-chlorophenyl)sulfanylpropanoylamino]-2-methoxy-phenyl]pyridine-3-carboxamide Openeye Name: N-[4-[3-(4-chlorophenyl)sulfanylpropanoylamino]-2-methoxy-phenyl]pyridine-3-carboxamide CAS Name: N-[4-[[3-[(4-chlorophenyl)thio]-1-oxopropyl]amino]-2-methoxyphenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-[3-(4-chlorophenyl)sulfanylpropanoylamino]-2-methoxyphenyl]pyridine-3-carboxamide Traditional Name: N-[4-[3-[(4-chlorophenyl)thio]propanoylamino]-2-methoxy-phenyl]nicotinamide Formula: C22H20ClN3O3S MolecularWeight: 441.9305

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)CCSC2=CC=C(C=C2)Cl)NC(=O)C3=CN=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)CCSC2=CC=C(C=C2)Cl)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C22H20ClN3O3S/c1-29-20-13-17(6-9-19(20)26-22(28)15-3-2-11-24-14-15)25-21(27)10-12-30-18-7-4-16(23)5-8-18/h2-9,11,13-14H,10,12H2,1H3,(H,25,27)(H,26,28)