(2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3-cyanothiophen-2-yl)-3-phenyl-propanamide

Systemtic Name: (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3-cyanothiophen-2-yl)-3-phenyl-propanamide Openeye Name: (2S)-N-(3-cyano-2-thienyl)-2-(1,3-dioxoisoindolin-2-yl)-3-phenyl-propanamide CAS Name: (2S)-N-(3-cyano-2-thiophenyl)-2-(1,3-dioxo-2-isoindolyl)-3-phenylpropanamide IUPAC Name: (2S)-N-(3-cyanothiophen-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide Traditional Name: (2S)-N-(3-cyano-2-thienyl)-3-phenyl-2-phthalimido-propionamide Formula: C22H15N3O3S MolecularWeight: 401.4378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=C(C=CS2)C#N)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NC2=C(C=CS2)C#N)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H15N3O3S/c23-13-15-10-11-29-20(15)24-19(26)18(12-14-6-2-1-3-7-14)25-21(27)16-8-4-5-9-17(16)22(25)28/h1-11,18H,12H2,(H,24,26)/t18-/m0/s1