4-[[(6S)-3-ethyl-2-(4-methoxyphenyl)imino-4-oxidanylidene-1,3-thiazinan-6-yl]carbonylamino]benzoate

Systemtic Name: 4-[[(6S)-3-ethyl-2-(4-methoxyphenyl)imino-4-oxidanylidene-1,3-thiazinan-6-yl]carbonylamino]benzoate Openeye Name: 4-[[(6S)-3-ethyl-2-(4-methoxyphenyl)imino-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoate CAS Name: 4-[[[(6S)-3-ethyl-2-(4-methoxyphenyl)imino-4-oxo-1,3-thiazinan-6-yl]-oxomethyl]amino]benzoate IUPAC Name: 4-[[(6S)-3-ethyl-2-(4-methoxyphenyl)imino-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoate Traditional Name: 4-[[(6S)-3-ethyl-4-keto-2-(4-methoxyphenyl)imino-1,3-thiazinane-6-carbonyl]amino]benzoate Formula: C21H20N3O5S- MolecularWeight: 426.4656

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)CC(SC1=NC2=CC=C(C=C2)OC)C(=O)NC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CCN1C(=O)C[C@H](SC1=NC2=CC=C(C=C2)OC)C(=O)NC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C21H21N3O5S/c1-3-24-18(25)12-17(19(26)22-14-6-4-13(5-7-14)20(27)28)30-21(24)23-15-8-10-16(29-2)11-9-15/h4-11,17H,3,12H2,1-2H3,(H,22,26)(H,27,28)/p-1/t17-/m0/s1