3-(4-fluorophenyl)-N-[4-(2-methoxyphenyl)piperazin-1-yl]carbothioyl-prop-2-enamide

Systemtic Name: 3-(4-fluorophenyl)-N-[4-(2-methoxyphenyl)piperazin-1-yl]carbothioyl-prop-2-enamide Openeye Name: 3-(4-fluorophenyl)-N-[4-(2-methoxyphenyl)piperazine-1-carbothioyl]prop-2-enamide CAS Name: 3-(4-fluorophenyl)-N-[[4-(2-methoxyphenyl)-1-piperazinyl]-sulfanylidenemethyl]-2-propenamide IUPAC Name: 3-(4-fluorophenyl)-N-[4-(2-methoxyphenyl)piperazine-1-carbothioyl]prop-2-enamide Traditional Name: 3-(4-fluorophenyl)-N-[4-(2-methoxyphenyl)piperazine-1-carbothioyl]acrylamide Formula: C21H22FN3O2S MolecularWeight: 399.481683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=S)NC(=O)C=CC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=S)NC(=O)C=CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FN3O2S/c1-27-19-5-3-2-4-18(19)24-12-14-25(15-13-24)21(28)23-20(26)11-8-16-6-9-17(22)10-7-16/h2-11H,12-15H2,1H3,(H,23,26,28)