N-(3-aminocarbonyl-5-methyl-4-phenyl-thiophen-2-yl)-6-chloranyl-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-(3-aminocarbonyl-5-methyl-4-phenyl-thiophen-2-yl)-6-chloranyl-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-(3-carbamoyl-5-methyl-4-phenyl-2-thienyl)-6-chloro-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-(3-carbamoyl-5-methyl-4-phenyl-2-thiophenyl)-6-chloro-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(3-carbamoyl-5-methyl-4-phenylthiophen-2-yl)-6-chloro-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-(3-carbamoyl-5-methyl-4-phenyl-2-thienyl)-6-chloro-2-(3-pyridyl)cinchoninamide Formula: C27H19ClN4O2S MolecularWeight: 498.98336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CN=CC=C4)C(=O)N)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CN=CC=C4)C(=O)N)C5=CC=CC=C5

InChI

InChI=1S/C27H19ClN4O2S/c1-15-23(16-6-3-2-4-7-16)24(25(29)33)27(35-15)32-26(34)20-13-22(17-8-5-11-30-14-17)31-21-10-9-18(28)12-19(20)21/h2-14H,1H3,(H2,29,33)(H,32,34)