4-methylsulfonyl-2-(3-oxidanylidene-1H-isoindol-2-yl)-N-[2-(2,3,4-trimethoxyphenyl)ethyl]butanamide

Systemtic Name: 4-methylsulfonyl-2-(3-oxidanylidene-1H-isoindol-2-yl)-N-[2-(2,3,4-trimethoxyphenyl)ethyl]butanamide Openeye Name: 4-methylsulfonyl-2-(1-oxoisoindolin-2-yl)-N-[2-(2,3,4-trimethoxyphenyl)ethyl]butanamide CAS Name: 4-methylsulfonyl-2-(3-oxo-1H-isoindol-2-yl)-N-[2-(2,3,4-trimethoxyphenyl)ethyl]butanamide IUPAC Name: 4-methylsulfonyl-2-(3-oxo-1H-isoindol-2-yl)-N-[2-(2,3,4-trimethoxyphenyl)ethyl]butanamide Traditional Name: 2-(1-ketoisoindolin-2-yl)-4-mesyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]butyramide Formula: C24H30N2O7S MolecularWeight: 490.5692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CCNC(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CCNC(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O)OC)OC

InChI

InChI=1S/C24H30N2O7S/c1-31-20-10-9-16(21(32-2)22(20)33-3)11-13-25-23(27)19(12-14-34(4,29)30)26-15-17-7-5-6-8-18(17)24(26)28/h5-10,19H,11-15H2,1-4H3,(H,25,27)