N-[3-[1-cyano-2-oxidanylidene-2-(phenethylamino)ethylidene]isoindol-1-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-[1-cyano-2-oxidanylidene-2-(phenethylamino)ethylidene]isoindol-1-yl]thiophene-2-carboxamide Openeye Name: N-[3-[1-cyano-2-oxo-2-(phenethylamino)ethylidene]isoindol-1-yl]thiophene-2-carboxamide CAS Name: N-[3-[1-cyano-2-oxo-2-(phenethylamino)ethylidene]-1-isoindolyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[1-cyano-2-oxo-2-(phenethylamino)ethylidene]isoindol-1-yl]thiophene-2-carboxamide Traditional Name: N-[3-[1-cyano-2-keto-2-(phenethylamino)ethylidene]isoindol-1-yl]thiophene-2-carboxamide Formula: C24H18N4O2S MolecularWeight: 426.49032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C(=C2C3=CC=CC=C3C(=N2)NC(=O)C4=CC=CS4)C#N

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C(=C2C3=CC=CC=C3C(=N2)NC(=O)C4=CC=CS4)C#N

InChI

InChI=1S/C24H18N4O2S/c25-15-19(23(29)26-13-12-16-7-2-1-3-8-16)21-17-9-4-5-10-18(17)22(27-21)28-24(30)20-11-6-14-31-20/h1-11,14H,12-13H2,(H,26,29)(H,27,28,30)