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

Systemtic Name: 3-[[2-(3-methoxyphenyl)imino-3-methyl-4-oxidanylidene-1,3-thiazinan-6-yl]carbonylamino]benzoic acid Openeye Name: 3-[[2-(3-methoxyphenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid CAS Name: 3-[[[2-(3-methoxyphenyl)imino-3-methyl-4-oxo-1,3-thiazinan-6-yl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[2-(3-methoxyphenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid Traditional Name: 3-[[4-keto-2-(3-methoxyphenyl)imino-3-methyl-1,3-thiazinane-6-carbonyl]amino]benzoic acid Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O5S/c1-23-17(24)11-16(18(25)21-13-6-3-5-12(9-13)19(26)27)29-20(23)22-14-7-4-8-15(10-14)28-2/h3-10,16H,11H2,1-2H3,(H,21,25)(H,26,27)