7-chloranyl-N-[1-(4-ethylphenyl)ethyl]-2-(5-ethylthiophen-2-yl)-8-methyl-quinoline-4-carboxamide

Systemtic Name: 7-chloranyl-N-[1-(4-ethylphenyl)ethyl]-2-(5-ethylthiophen-2-yl)-8-methyl-quinoline-4-carboxamide Openeye Name: 7-chloro-N-[1-(4-ethylphenyl)ethyl]-2-(5-ethyl-2-thienyl)-8-methyl-quinoline-4-carboxamide CAS Name: 7-chloro-N-[1-(4-ethylphenyl)ethyl]-2-(5-ethyl-2-thiophenyl)-8-methyl-4-quinolinecarboxamide IUPAC Name: 7-chloro-N-[1-(4-ethylphenyl)ethyl]-2-(5-ethylthiophen-2-yl)-8-methylquinoline-4-carboxamide Traditional Name: 7-chloro-N-[1-(4-ethylphenyl)ethyl]-2-(5-ethyl-2-thienyl)-8-methyl-cinchoninamide Formula: C27H27ClN2OS MolecularWeight: 463.03408

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)NC(=O)C2=CC(=NC3=C2C=CC(=C3C)Cl)C4=CC=C(S4)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C(C)NC(=O)C2=CC(=NC3=C2C=CC(=C3C)Cl)C4=CC=C(S4)CC

InChI

InChI=1S/C27H27ClN2OS/c1-5-18-7-9-19(10-8-18)17(4)29-27(31)22-15-24(25-14-11-20(6-2)32-25)30-26-16(3)23(28)13-12-21(22)26/h7-15,17H,5-6H2,1-4H3,(H,29,31)