3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: 3-(1-methylene-3-oxo-isoindolin-2-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: 3-(1-methylene-3-oxo-2-isoindolyl)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 3-(1-methylidene-3-oxoisoindol-2-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 3-(1-keto-3-methylene-isoindolin-2-yl)-N-(4-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=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

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

InChI

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