(4-benzamidophenyl) 2-(2-oxidanylidenepropylsulfanyl)benzoate

Systemtic Name: (4-benzamidophenyl) 2-(2-oxidanylidenepropylsulfanyl)benzoate Openeye Name: (4-benzamidophenyl) 2-acetonylsulfanylbenzoate CAS Name: 2-(2-oxopropylthio)benzoic acid (4-benzamidophenyl) ester IUPAC Name: (4-benzamidophenyl) 2-(2-oxopropylsulfanyl)benzoate Traditional Name: 2-(acetonylthio)benzoic acid (4-benzamidophenyl) ester Formula: C23H19NO4S MolecularWeight: 405.46626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=CC=CC=C1C(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)CSC1=CC=CC=C1C(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H19NO4S/c1-16(25)15-29-21-10-6-5-9-20(21)23(27)28-19-13-11-18(12-14-19)24-22(26)17-7-3-2-4-8-17/h2-14H,15H2,1H3,(H,24,26)