3-(4-chlorophenyl)sulfanyl-1-(phenylmethyl)pyrrole-2,5-dione

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-1-(phenylmethyl)pyrrole-2,5-dione Openeye Name: 1-benzyl-3-(4-chlorophenyl)sulfanyl-pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-1-(phenylmethyl)pyrrole-2,5-dione IUPAC Name: 1-benzyl-3-(4-chlorophenyl)sulfanylpyrrole-2,5-dione Traditional Name: 1-benzyl-3-[(4-chlorophenyl)thio]-3-pyrroline-2,5-quinone Formula: C17H12ClNO2S MolecularWeight: 329.80068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C=C(C2=O)SC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C=C(C2=O)SC3=CC=C(C=C3)Cl

InChI

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