4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)butanamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)butanamide Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]butanamide CAS Name: 4-(1,3-dioxo-2-isoindolyl)-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]butanamide IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)butanamide Traditional Name: 4-phthalimido-N-[2-pyrrolidino-2-(2-thienyl)ethyl]butyramide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)C4=CC=CS4

InChI

InChI=1S/C22H25N3O3S/c26-20(23-15-18(19-9-6-14-29-19)24-11-3-4-12-24)10-5-13-25-21(27)16-7-1-2-8-17(16)22(25)28/h1-2,6-9,14,18H,3-5,10-13,15H2,(H,23,26)