4-(2-chlorophenyl)-5-cyano-2-methyl-N-phenyl-6-propylsulfanyl-pyridine-3-carboxamide

Systemtic Name: 4-(2-chlorophenyl)-5-cyano-2-methyl-N-phenyl-6-propylsulfanyl-pyridine-3-carboxamide Openeye Name: 4-(2-chlorophenyl)-5-cyano-2-methyl-N-phenyl-6-propylsulfanyl-pyridine-3-carboxamide CAS Name: 4-(2-chlorophenyl)-5-cyano-2-methyl-N-phenyl-6-(propylthio)-3-pyridinecarboxamide IUPAC Name: 4-(2-chlorophenyl)-5-cyano-2-methyl-N-phenyl-6-propylsulfanylpyridine-3-carboxamide Traditional Name: 4-(2-chlorophenyl)-5-cyano-2-methyl-N-phenyl-6-(propylthio)nicotinamide Formula: C23H20ClN3OS MolecularWeight: 421.9424

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=C(C(=C1C#N)C2=CC=CC=C2Cl)C(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CCCSC1=NC(=C(C(=C1C#N)C2=CC=CC=C2Cl)C(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C23H20ClN3OS/c1-3-13-29-23-18(14-25)21(17-11-7-8-12-19(17)24)20(15(2)26-23)22(28)27-16-9-5-4-6-10-16/h4-12H,3,13H2,1-2H3,(H,27,28)