5-cyano-2-methyl-6-[2-[3-[methyl(phenyl)amino]propylamino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 5-cyano-2-methyl-6-[2-[3-[methyl(phenyl)amino]propylamino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide Openeye Name: 5-cyano-2-methyl-6-[2-[3-(N-methylanilino)propylamino]-2-oxo-ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide CAS Name: 5-cyano-2-methyl-6-[[2-[3-(N-methylanilino)propylamino]-2-oxoethyl]thio]-N-phenyl-3-pyridinecarboxamide IUPAC Name: 5-cyano-2-methyl-6-[2-[3-(N-methylanilino)propylamino]-2-oxoethyl]sulfanyl-N-phenylpyridine-3-carboxamide Traditional Name: 5-cyano-6-[[2-keto-2-[3-(N-methylanilino)propylamino]ethyl]thio]-2-methyl-N-phenyl-nicotinamide Formula: C26H27N5O2S MolecularWeight: 473.58988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27N5O2S/c1-19-23(25(33)30-21-10-5-3-6-11-21)16-20(17-27)26(29-19)34-18-24(32)28-14-9-15-31(2)22-12-7-4-8-13-22/h3-8,10-13,16H,9,14-15,18H2,1-2H3,(H,28,32)(H,30,33)