2-[(4-chlorophenyl)sulfanyl-prop-2-enyl-amino]isoindole-1,3-dione

Systemtic Name: 2-[(4-chlorophenyl)sulfanyl-prop-2-enyl-amino]isoindole-1,3-dione Openeye Name: 2-[allyl-(4-chlorophenyl)sulfanyl-amino]isoindoline-1,3-dione CAS Name: 4-chloro-N-(1,3-dioxo-2-isoindolyl)-N-prop-2-enylbenzenesulfenamide IUPAC Name: 2-[(4-chlorophenyl)sulfanyl-prop-2-enylamino]isoindole-1,3-dione Traditional Name: 2-[allyl-[(4-chlorophenyl)thio]amino]isoindoline-1,3-quinone Formula: C17H13ClN2O2S MolecularWeight: 344.81532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN(N1C(=O)C2=CC=CC=C2C1=O)SC3=CC=C(C=C3)Cl

Isomeric SMILES

C=CCN(N1C(=O)C2=CC=CC=C2C1=O)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H13ClN2O2S/c1-2-11-19(23-13-9-7-12(18)8-10-13)20-16(21)14-5-3-4-6-15(14)17(20)22/h2-10H,1,11H2