5-cyano-2-methyl-6-(3-phenoxypropylsulfanyl)-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 5-cyano-2-methyl-6-(3-phenoxypropylsulfanyl)-N-phenyl-pyridine-3-carboxamide Openeye Name: 5-cyano-2-methyl-6-(3-phenoxypropylsulfanyl)-N-phenyl-pyridine-3-carboxamide CAS Name: 5-cyano-2-methyl-6-(3-phenoxypropylthio)-N-phenyl-3-pyridinecarboxamide IUPAC Name: 5-cyano-2-methyl-6-(3-phenoxypropylsulfanyl)-N-phenylpyridine-3-carboxamide Traditional Name: 5-cyano-2-methyl-6-(3-phenoxypropylthio)-N-phenyl-nicotinamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCCCOC2=CC=CC=C2)C#N)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C(=N1)SCCCOC2=CC=CC=C2)C#N)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H21N3O2S/c1-17-21(22(27)26-19-9-4-2-5-10-19)15-18(16-24)23(25-17)29-14-8-13-28-20-11-6-3-7-12-20/h2-7,9-12,15H,8,13-14H2,1H3,(H,26,27)