1-[2-chloranyl-4-(1-oxidanylidene-2,3-dihydroisoindol-4-yl)phenyl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[2-chloranyl-4-(1-oxidanylidene-2,3-dihydroisoindol-4-yl)phenyl]-3-(3-methylphenyl)urea Openeye Name: 1-[2-chloro-4-(1-oxoisoindolin-4-yl)phenyl]-3-(m-tolyl)urea CAS Name: 1-[2-chloro-4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-(3-methylphenyl)urea IUPAC Name: 1-[2-chloro-4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-(3-methylphenyl)urea Traditional Name: 1-[2-chloro-4-(1-ketoisoindolin-4-yl)phenyl]-3-(m-tolyl)urea Formula: C22H18ClN3O2 MolecularWeight: 391.85022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=C(C=C(C=C2)C3=C4CNC(=O)C4=CC=C3)Cl

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=C(C=C(C=C2)C3=C4CNC(=O)C4=CC=C3)Cl

InChI

InChI=1S/C22H18ClN3O2/c1-13-4-2-5-15(10-13)25-22(28)26-20-9-8-14(11-19(20)23)16-6-3-7-17-18(16)12-24-21(17)27/h2-11H,12H2,1H3,(H,24,27)(H2,25,26,28)