2-methyl-1-oxidanylidene-3-thiophen-2-yl-N-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-methyl-1-oxidanylidene-3-thiophen-2-yl-N-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-methyl-1-oxo-3-(2-thienyl)-N-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-methyl-1-oxo-3-thiophen-2-yl-N-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-methyl-1-oxo-3-thiophen-2-yl-N-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 1-keto-2-methyl-3-(2-thienyl)-N-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinoline-4-carboxamide Formula: C22H17F3N2O2S MolecularWeight: 430.44279

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=CS4

Isomeric SMILES

CN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=CS4

InChI

InChI=1S/C22H17F3N2O2S/c1-27-19(17-10-5-11-30-17)18(15-8-2-3-9-16(15)21(27)29)20(28)26-14-7-4-6-13(12-14)22(23,24)25/h2-12,18-19H,1H3,(H,26,28)