(E)-3-(4-fluorophenyl)-N-[(2-methylquinolin-8-yl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-fluorophenyl)-N-[(2-methylquinolin-8-yl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-fluorophenyl)-N-[(2-methyl-8-quinolyl)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-fluorophenyl)-N-[[(2-methyl-8-quinolinyl)amino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-fluorophenyl)-N-[(2-methylquinolin-8-yl)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(4-fluorophenyl)-N-[(2-methyl-8-quinolyl)thiocarbamoyl]acrylamide Formula: C20H16FN3OS MolecularWeight: 365.423943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC(=S)NC(=O)C=CC3=CC=C(C=C3)F)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC(=S)NC(=O)/C=C/C3=CC=C(C=C3)F)C=C1

InChI

InChI=1S/C20H16FN3OS/c1-13-5-9-15-3-2-4-17(19(15)22-13)23-20(26)24-18(25)12-8-14-6-10-16(21)11-7-14/h2-12H,1H3,(H2,23,24,25,26)/b12-8+