N-(2-dimethylaminoethyl)-N-[[7-fluoranyl-2-(2-methylphenyl)quinolin-3-yl]methyl]-5-methyl-thiophene-2-carboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-[[7-fluoranyl-2-(2-methylphenyl)quinolin-3-yl]methyl]-5-methyl-thiophene-2-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-N-[[7-fluoro-2-(o-tolyl)-3-quinolyl]methyl]-5-methyl-thiophene-2-carboxamide CAS Name: N-(2-dimethylaminoethyl)-N-[[7-fluoro-2-(2-methylphenyl)-3-quinolinyl]methyl]-5-methyl-2-thiophenecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-N-[[7-fluoro-2-(2-methylphenyl)quinolin-3-yl]methyl]-5-methylthiophene-2-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-N-[[7-fluoro-2-(o-tolyl)-3-quinolyl]methyl]-5-methyl-thiophene-2-carboxamide Formula: C27H28FN3OS MolecularWeight: 461.594123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=C3C=CC(=CC3=N2)F)CN(CCN(C)C)C(=O)C4=CC=C(S4)C

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=C3C=CC(=CC3=N2)F)CN(CCN(C)C)C(=O)C4=CC=C(S4)C

InChI

InChI=1S/C27H28FN3OS/c1-18-7-5-6-8-23(18)26-21(15-20-10-11-22(28)16-24(20)29-26)17-31(14-13-30(3)4)27(32)25-12-9-19(2)33-25/h5-12,15-16H,13-14,17H2,1-4H3