ethyl 4-[(3-methyl-4-oxidanylidene-2-phenylimino-1,3-thiazinan-6-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(3-methyl-4-oxidanylidene-2-phenylimino-1,3-thiazinan-6-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[(3-methyl-4-oxo-2-phenylimino-1,3-thiazinane-6-carbonyl)amino]benzoate CAS Name: 4-[[(3-methyl-4-oxo-2-phenylimino-1,3-thiazinan-6-yl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-methyl-4-oxo-2-phenylimino-1,3-thiazinane-6-carbonyl)amino]benzoate Traditional Name: 4-[(4-keto-3-methyl-2-phenylimino-1,3-thiazinane-6-carbonyl)amino]benzoic acid ethyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O4S/c1-3-28-20(27)14-9-11-16(12-10-14)22-19(26)17-13-18(25)24(2)21(29-17)23-15-7-5-4-6-8-15/h4-12,17H,3,13H2,1-2H3,(H,22,26)