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

Systemtic Name: ethyl 4-[[6-[(4-fluorophenyl)carbamoyl]-4-oxidanylidene-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[6-[(4-fluorophenyl)carbamoyl]-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoate CAS Name: 4-[[6-[(4-fluoroanilino)-oxomethyl]-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[6-[(4-fluorophenyl)carbamoyl]-4-oxo-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoate Traditional Name: 4-[[6-[(4-fluorophenyl)carbamoyl]-4-keto-3-phenethyl-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester Formula: C28H26FN3O4S MolecularWeight: 519.587143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC=C(C=C3)F)CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC=C(C=C3)F)CCC4=CC=CC=C4

InChI

InChI=1S/C28H26FN3O4S/c1-2-36-27(35)20-8-12-23(13-9-20)31-28-32(17-16-19-6-4-3-5-7-19)25(33)18-24(37-28)26(34)30-22-14-10-21(29)11-15-22/h3-15,24H,2,16-18H2,1H3,(H,30,34)