3-[(4-oxidanylidene-3-phenethyl-2-phenylimino-1,3-thiazinan-6-yl)carbonylamino]benzoic acid

Systemtic Name: 3-[(4-oxidanylidene-3-phenethyl-2-phenylimino-1,3-thiazinan-6-yl)carbonylamino]benzoic acid Openeye Name: 3-[(4-oxo-3-phenethyl-2-phenylimino-1,3-thiazinane-6-carbonyl)amino]benzoic acid CAS Name: 3-[[oxo-(4-oxo-3-phenethyl-2-phenylimino-1,3-thiazinan-6-yl)methyl]amino]benzoic acid IUPAC Name: 3-[(4-oxo-3-phenethyl-2-phenylimino-1,3-thiazinane-6-carbonyl)amino]benzoic acid Traditional Name: 3-[(4-keto-3-phenethyl-2-phenylimino-1,3-thiazinane-6-carbonyl)amino]benzoic acid Formula: C26H23N3O4S MolecularWeight: 473.54352

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC(=NC2=CC=CC=C2)N(C1=O)CCC3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1C(SC(=NC2=CC=CC=C2)N(C1=O)CCC3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C26H23N3O4S/c30-23-17-22(24(31)27-21-13-7-10-19(16-21)25(32)33)34-26(28-20-11-5-2-6-12-20)29(23)15-14-18-8-3-1-4-9-18/h1-13,16,22H,14-15,17H2,(H,27,31)(H,32,33)