N-[(3Z)-3-[1-cyano-2-(2-methylpropylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]-4-methoxy-benzamide

Systemtic Name: N-[(3Z)-3-[1-cyano-2-(2-methylpropylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]-4-methoxy-benzamide Openeye Name: N-[(3Z)-3-[1-cyano-2-(isobutylamino)-2-oxo-ethylidene]isoindol-1-yl]-4-methoxy-benzamide CAS Name: N-[(3Z)-3-[1-cyano-2-(2-methylpropylamino)-2-oxoethylidene]-1-isoindolyl]-4-methoxybenzamide IUPAC Name: N-[(3Z)-3-[1-cyano-2-(2-methylpropylamino)-2-oxoethylidene]isoindol-1-yl]-4-methoxybenzamide Traditional Name: N-[(3Z)-3-[1-cyano-2-(isobutylamino)-2-keto-ethylidene]isoindol-1-yl]-4-methoxy-benzamide Formula: C23H22N4O3 MolecularWeight: 402.44578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(=C1C2=CC=CC=C2C(=N1)NC(=O)C3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CC(C)CNC(=O)/C(=C\1/C2=CC=CC=C2C(=N1)NC(=O)C3=CC=C(C=C3)OC)/C#N

InChI

InChI=1S/C23H22N4O3/c1-14(2)13-25-23(29)19(12-24)20-17-6-4-5-7-18(17)21(26-20)27-22(28)15-8-10-16(30-3)11-9-15/h4-11,14H,13H2,1-3H3,(H,25,29)(H,26,27,28)/b20-19-