4-azanyl-2-[3-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonyl-isoindole-1,3-dione

Systemtic Name: 4-azanyl-2-[3-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonyl-isoindole-1,3-dione Openeye Name: 4-amino-2-[3-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoyl]isoindoline-1,3-dione CAS Name: 4-amino-2-[[3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]isoindole-1,3-dione IUPAC Name: 4-amino-2-[3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoyl]isoindole-1,3-dione Traditional Name: 4-amino-2-[3-(3,5-dimethylpiperidino)sulfonylbenzoyl]isoindoline-1,3-quinone Formula: C22H23N3O5S MolecularWeight: 441.50012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3C(=O)C4=C(C3=O)C(=CC=C4)N)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3C(=O)C4=C(C3=O)C(=CC=C4)N)C

InChI

InChI=1S/C22H23N3O5S/c1-13-9-14(2)12-24(11-13)31(29,30)16-6-3-5-15(10-16)20(26)25-21(27)17-7-4-8-18(23)19(17)22(25)28/h3-8,10,13-14H,9,11-12,23H2,1-2H3