3-[2-[1-(3-ethoxy-4-methoxy-phenyl)-2-methylsulfonyl-ethyl]-3-oxidanylidene-1H-isoindol-4-yl]-1,1-dimethyl-urea

Systemtic Name: 3-[2-[1-(3-ethoxy-4-methoxy-phenyl)-2-methylsulfonyl-ethyl]-3-oxidanylidene-1H-isoindol-4-yl]-1,1-dimethyl-urea Openeye Name: 3-[2-[1-(3-ethoxy-4-methoxy-phenyl)-2-methylsulfonyl-ethyl]-3-oxo-isoindolin-4-yl]-1,1-dimethyl-urea CAS Name: 3-[2-[1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-3-oxo-1H-isoindol-4-yl]-1,1-dimethylurea IUPAC Name: 3-[2-[1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-3-oxo-1H-isoindol-4-yl]-1,1-dimethylurea Traditional Name: 3-[2-[1-(3-ethoxy-4-methoxy-phenyl)-2-mesyl-ethyl]-3-keto-isoindolin-4-yl]-1,1-dimethyl-urea Formula: C23H29N3O6S MolecularWeight: 475.55786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(CS(=O)(=O)C)N2CC3=C(C2=O)C(=CC=C3)NC(=O)N(C)C)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(CS(=O)(=O)C)N2CC3=C(C2=O)C(=CC=C3)NC(=O)N(C)C)OC

InChI

InChI=1S/C23H29N3O6S/c1-6-32-20-12-15(10-11-19(20)31-4)18(14-33(5,29)30)26-13-16-8-7-9-17(21(16)22(26)27)24-23(28)25(2)3/h7-12,18H,6,13-14H2,1-5H3,(H,24,28)