2-[(4-chlorophenyl)methyl]-5-(phenylcarbonyl)-1,2-thiazol-3-one

Systemtic Name: 2-[(4-chlorophenyl)methyl]-5-(phenylcarbonyl)-1,2-thiazol-3-one Openeye Name: 5-benzoyl-2-[(4-chlorophenyl)methyl]isothiazol-3-one CAS Name: 5-benzoyl-2-[(4-chlorophenyl)methyl]-3-isothiazolone IUPAC Name: 5-benzoyl-2-[(4-chlorophenyl)methyl]-1,2-thiazol-3-one Traditional Name: 5-benzoyl-2-(4-chlorobenzyl)-4-isothiazolin-3-one Formula: C17H12ClNO2S MolecularWeight: 329.80068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC(=O)N(S2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC(=O)N(S2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H12ClNO2S/c18-14-8-6-12(7-9-14)11-19-16(20)10-15(22-19)17(21)13-4-2-1-3-5-13/h1-10H,11H2