2-cyano-2-[1-(3-methylbutyl)-2-oxidanylidene-indol-3-ylidene]-N-(5-methyl-2-phenyl-pyrazol-3-yl)ethanamide

Systemtic Name: 2-cyano-2-[1-(3-methylbutyl)-2-oxidanylidene-indol-3-ylidene]-N-(5-methyl-2-phenyl-pyrazol-3-yl)ethanamide Openeye Name: 2-cyano-2-(1-isopentyl-2-oxo-indolin-3-ylidene)-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: 2-cyano-2-[1-(3-methylbutyl)-2-oxo-3-indolylidene]-N-(5-methyl-2-phenyl-3-pyrazolyl)acetamide IUPAC Name: 2-cyano-2-[1-(3-methylbutyl)-2-oxoindol-3-ylidene]-N-(5-methyl-2-phenylpyrazol-3-yl)acetamide Traditional Name: 2-cyano-2-(1-isoamyl-2-keto-indolin-3-ylidene)-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide Formula: C26H25N5O2 MolecularWeight: 439.509

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C(=C2C3=CC=CC=C3N(C2=O)CCC(C)C)C#N)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C(=C2C3=CC=CC=C3N(C2=O)CCC(C)C)C#N)C4=CC=CC=C4

InChI

InChI=1S/C26H25N5O2/c1-17(2)13-14-30-22-12-8-7-11-20(22)24(26(30)33)21(16-27)25(32)28-23-15-18(3)29-31(23)19-9-5-4-6-10-19/h4-12,15,17H,13-14H2,1-3H3,(H,28,32)