ethyl 4-[[3-ethyl-6-[(2-fluorophenyl)carbamoyl]-4-oxidanylidene-1,3-thiazinan-2-ylidene]amino]benzoate

Systemtic Name: ethyl 4-[[3-ethyl-6-[(2-fluorophenyl)carbamoyl]-4-oxidanylidene-1,3-thiazinan-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[3-ethyl-6-[(2-fluorophenyl)carbamoyl]-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate CAS Name: 4-[[3-ethyl-6-[(2-fluoroanilino)-oxomethyl]-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-ethyl-6-[(2-fluorophenyl)carbamoyl]-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate Traditional Name: 4-[[3-ethyl-6-[(2-fluorophenyl)carbamoyl]-4-keto-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester Formula: C22H22FN3O4S MolecularWeight: 443.491183

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)CC(SC1=NC2=CC=C(C=C2)C(=O)OCC)C(=O)NC3=CC=CC=C3F

Isomeric SMILES

CCN1C(=O)CC(SC1=NC2=CC=C(C=C2)C(=O)OCC)C(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C22H22FN3O4S/c1-3-26-19(27)13-18(20(28)25-17-8-6-5-7-16(17)23)31-22(26)24-15-11-9-14(10-12-15)21(29)30-4-2/h5-12,18H,3-4,13H2,1-2H3,(H,25,28)