[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] 4-(1,3-dithian-2-yl)benzoate

Systemtic Name: [2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] 4-(1,3-dithian-2-yl)benzoate Openeye Name: [2-(3-fluoroanilino)-2-oxo-ethyl] 4-(1,3-dithian-2-yl)benzoate CAS Name: 4-(1,3-dithian-2-yl)benzoic acid [2-(3-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-fluoroanilino)-2-oxoethyl] 4-(1,3-dithian-2-yl)benzoate Traditional Name: 4-(1,3-dithian-2-yl)benzoic acid [2-(3-fluoroanilino)-2-keto-ethyl] ester Formula: C19H18FNO3S2 MolecularWeight: 391.479523

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

C1CSC(SC1)C2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C19H18FNO3S2/c20-15-3-1-4-16(11-15)21-17(22)12-24-18(23)13-5-7-14(8-6-13)19-25-9-2-10-26-19/h1,3-8,11,19H,2,9-10,12H2,(H,21,22)