N-(3-cyano-5-methyl-4-phenyl-thiophen-2-yl)-6,8-dimethyl-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-(3-cyano-5-methyl-4-phenyl-thiophen-2-yl)-6,8-dimethyl-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-(3-cyano-5-methyl-4-phenyl-2-thienyl)-6,8-dimethyl-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-(3-cyano-5-methyl-4-phenyl-2-thiophenyl)-6,8-dimethyl-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(3-cyano-5-methyl-4-phenylthiophen-2-yl)-6,8-dimethyl-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-(3-cyano-5-methyl-4-phenyl-2-thienyl)-6,8-dimethyl-2-(3-pyridyl)cinchoninamide Formula: C29H22N4OS MolecularWeight: 474.57618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)NC4=C(C(=C(S4)C)C5=CC=CC=C5)C#N)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)NC4=C(C(=C(S4)C)C5=CC=CC=C5)C#N)C

InChI

InChI=1S/C29H22N4OS/c1-17-12-18(2)27-22(13-17)23(14-25(32-27)21-10-7-11-31-16-21)28(34)33-29-24(15-30)26(19(3)35-29)20-8-5-4-6-9-20/h4-14,16H,1-3H3,(H,33,34)