3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: 3-(1-methylene-3-oxo-isoindolin-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: 3-(1-methylene-3-oxo-2-isoindolyl)-N-[3-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 3-(1-methylidene-3-oxoisoindol-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 3-(1-keto-3-methylene-isoindolin-2-yl)-N-(3-pyrrolidinosulfonylphenyl)propionamide Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=CC=CC=C2C(=O)N1CCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

C=C1C2=CC=CC=C2C(=O)N1CCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H23N3O4S/c1-16-19-9-2-3-10-20(19)22(27)25(16)14-11-21(26)23-17-7-6-8-18(15-17)30(28,29)24-12-4-5-13-24/h2-3,6-10,15H,1,4-5,11-14H2,(H,23,26)