4-(4-bromophenyl)-5-cyano-6-ethylsulfanyl-2-methyl-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 4-(4-bromophenyl)-5-cyano-6-ethylsulfanyl-2-methyl-N-phenyl-pyridine-3-carboxamide Openeye Name: 4-(4-bromophenyl)-5-cyano-6-ethylsulfanyl-2-methyl-N-phenyl-pyridine-3-carboxamide CAS Name: 4-(4-bromophenyl)-5-cyano-6-(ethylthio)-2-methyl-N-phenyl-3-pyridinecarboxamide IUPAC Name: 4-(4-bromophenyl)-5-cyano-6-ethylsulfanyl-2-methyl-N-phenylpyridine-3-carboxamide Traditional Name: 4-(4-bromophenyl)-5-cyano-6-(ethylthio)-2-methyl-N-phenyl-nicotinamide Formula: C22H18BrN3OS MolecularWeight: 452.36682

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=C(C(=C1C#N)C2=CC=C(C=C2)Br)C(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CCSC1=NC(=C(C(=C1C#N)C2=CC=C(C=C2)Br)C(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C22H18BrN3OS/c1-3-28-22-18(13-24)20(15-9-11-16(23)12-10-15)19(14(2)25-22)21(27)26-17-7-5-4-6-8-17/h4-12H,3H2,1-2H3,(H,26,27)