3-(3-cyano-3-phenyl-prop-1-ynyl)-N-[(4-methylsulfonylphenyl)methyl]pyridine-4-carboxamide

Systemtic Name: 3-(3-cyano-3-phenyl-prop-1-ynyl)-N-[(4-methylsulfonylphenyl)methyl]pyridine-4-carboxamide Openeye Name: 3-(3-cyano-3-phenyl-prop-1-ynyl)-N-[(4-methylsulfonylphenyl)methyl]pyridine-4-carboxamide CAS Name: 3-(3-cyano-3-phenylprop-1-ynyl)-N-[(4-methylsulfonylphenyl)methyl]-4-pyridinecarboxamide IUPAC Name: 3-(3-cyano-3-phenylprop-1-ynyl)-N-[(4-methylsulfonylphenyl)methyl]pyridine-4-carboxamide Traditional Name: 3-(3-cyano-3-phenyl-prop-1-ynyl)-N-(4-mesylbenzyl)isonicotinamide Formula: C24H19N3O3S MolecularWeight: 429.49096

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2=C(C=NC=C2)C#CC(C#N)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2=C(C=NC=C2)C#CC(C#N)C3=CC=CC=C3

InChI

InChI=1S/C24H19N3O3S/c1-31(29,30)22-11-7-18(8-12-22)16-27-24(28)23-13-14-26-17-21(23)10-9-20(15-25)19-5-3-2-4-6-19/h2-8,11-14,17,20H,16H2,1H3,(H,27,28)