N-[1-(3,4-dimethylphenyl)ethyl]-2-(5-ethylthiophen-2-yl)-8-methyl-quinoline-4-carboxamide

Systemtic Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-(5-ethylthiophen-2-yl)-8-methyl-quinoline-4-carboxamide Openeye Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-(5-ethyl-2-thienyl)-8-methyl-quinoline-4-carboxamide CAS Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-(5-ethyl-2-thiophenyl)-8-methyl-4-quinolinecarboxamide IUPAC Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-(5-ethylthiophen-2-yl)-8-methylquinoline-4-carboxamide Traditional Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-(5-ethyl-2-thienyl)-8-methyl-cinchoninamide Formula: C27H28N2OS MolecularWeight: 428.58902

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2=NC3=C(C=CC=C3C)C(=C2)C(=O)NC(C)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CCC1=CC=C(S1)C2=NC3=C(C=CC=C3C)C(=C2)C(=O)NC(C)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C27H28N2OS/c1-6-21-12-13-25(31-21)24-15-23(22-9-7-8-17(3)26(22)29-24)27(30)28-19(5)20-11-10-16(2)18(4)14-20/h7-15,19H,6H2,1-5H3,(H,28,30)