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

Systemtic Name: ethyl 4-[[(6S)-3-cyclopropyl-6-[(4-ethoxyphenyl)carbamoyl]-4-oxidanylidene-1,3-thiazinan-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[(6S)-3-cyclopropyl-6-[(4-ethoxyphenyl)carbamoyl]-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate CAS Name: 4-[[(6S)-3-cyclopropyl-6-[(4-ethoxyanilino)-oxomethyl]-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(6S)-3-cyclopropyl-6-[(4-ethoxyphenyl)carbamoyl]-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate Traditional Name: 4-[[(6S)-3-cyclopropyl-4-keto-6-(p-phenetylcarbamoyl)-1,3-thiazinan-2-ylidene]amino]benzoic acid ethyl ester Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=C(C=C3)C(=O)OCC)S2)C4CC4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)[C@@H]2CC(=O)N(C(=NC3=CC=C(C=C3)C(=O)OCC)S2)C4CC4

InChI

InChI=1S/C25H27N3O5S/c1-3-32-20-13-9-17(10-14-20)26-23(30)21-15-22(29)28(19-11-12-19)25(34-21)27-18-7-5-16(6-8-18)24(31)33-4-2/h5-10,13-14,19,21H,3-4,11-12,15H2,1-2H3,(H,26,30)/t21-/m0/s1