4-[[(6S)-2-(4-methoxycarbonylphenyl)imino-3-methyl-4-oxidanylidene-1,3-thiazinan-6-yl]carbonylamino]benzoic acid

Systemtic Name: 4-[[(6S)-2-(4-methoxycarbonylphenyl)imino-3-methyl-4-oxidanylidene-1,3-thiazinan-6-yl]carbonylamino]benzoic acid Openeye Name: 4-[[(6S)-2-(4-methoxycarbonylphenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid CAS Name: 4-[[[(6S)-2-(4-methoxycarbonylphenyl)imino-3-methyl-4-oxo-1,3-thiazinan-6-yl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[(6S)-2-(4-methoxycarbonylphenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid Traditional Name: 4-[[(6S)-2-(4-carbomethoxyphenyl)imino-4-keto-3-methyl-1,3-thiazinane-6-carbonyl]amino]benzoic acid Formula: C21H19N3O6S MolecularWeight: 441.45706

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CC(SC1=NC2=CC=C(C=C2)C(=O)OC)C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CN1C(=O)C[C@H](SC1=NC2=CC=C(C=C2)C(=O)OC)C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H19N3O6S/c1-24-17(25)11-16(18(26)22-14-7-3-12(4-8-14)19(27)28)31-21(24)23-15-9-5-13(6-10-15)20(29)30-2/h3-10,16H,11H2,1-2H3,(H,22,26)(H,27,28)/t16-/m0/s1