4-[[(6R)-2-(3-chlorophenyl)imino-4-oxidanylidene-3-prop-2-enyl-1,3-thiazinan-6-yl]carbonylamino]benzoic acid

Systemtic Name: 4-[[(6R)-2-(3-chlorophenyl)imino-4-oxidanylidene-3-prop-2-enyl-1,3-thiazinan-6-yl]carbonylamino]benzoic acid Openeye Name: 4-[[(6R)-3-allyl-2-(3-chlorophenyl)imino-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid CAS Name: 4-[[[(6R)-2-(3-chlorophenyl)imino-4-oxo-3-prop-2-enyl-1,3-thiazinan-6-yl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[(6R)-2-(3-chlorophenyl)imino-4-oxo-3-prop-2-enyl-1,3-thiazinane-6-carbonyl]amino]benzoic acid Traditional Name: 4-[[(6R)-3-allyl-2-(3-chlorophenyl)imino-4-keto-1,3-thiazinane-6-carbonyl]amino]benzoic acid Formula: C21H18ClN3O4S MolecularWeight: 443.90332

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)CC(SC1=NC2=CC(=CC=C2)Cl)C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClN3O4S/c1-2-10-25-18(26)12-17(30-21(25)24-16-5-3-4-14(22)11-16)19(27)23-15-8-6-13(7-9-15)20(28)29/h2-9,11,17H,1,10,12H2,(H,23,27)(H,28,29)/t17-/m1/s1