methyl 4-[[2-(4-chlorophenyl)imino-4-oxidanylidene-3-prop-2-enyl-1,3-thiazinan-6-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[2-(4-chlorophenyl)imino-4-oxidanylidene-3-prop-2-enyl-1,3-thiazinan-6-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[3-allyl-2-(4-chlorophenyl)imino-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoate CAS Name: 4-[[[2-(4-chlorophenyl)imino-4-oxo-3-prop-2-enyl-1,3-thiazinan-6-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-chlorophenyl)imino-4-oxo-3-prop-2-enyl-1,3-thiazinane-6-carbonyl]amino]benzoate Traditional Name: 4-[[3-allyl-2-(4-chlorophenyl)imino-4-keto-1,3-thiazinane-6-carbonyl]amino]benzoic acid methyl ester Formula: C22H20ClN3O4S MolecularWeight: 457.9299

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=C(C=C3)Cl)S2)CC=C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=C(C=C3)Cl)S2)CC=C

InChI

InChI=1S/C22H20ClN3O4S/c1-3-12-26-19(27)13-18(31-22(26)25-17-10-6-15(23)7-11-17)20(28)24-16-8-4-14(5-9-16)21(29)30-2/h3-11,18H,1,12-13H2,2H3,(H,24,28)