3-[2-(2,3-dihydroindol-1-yl)-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl]propanenitrile

Systemtic Name: 3-[2-(2,3-dihydroindol-1-yl)-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl]propanenitrile Openeye Name: 3-(2-indolin-1-yl-4-oxo-6-phenyl-1H-pyrimidin-5-yl)propanenitrile CAS Name: 3-[2-(2,3-dihydroindol-1-yl)-4-oxo-6-phenyl-1H-pyrimidin-5-yl]propanenitrile IUPAC Name: 3-[2-(2,3-dihydroindol-1-yl)-4-oxo-6-phenyl-1H-pyrimidin-5-yl]propanenitrile Traditional Name: 3-(2-indolin-1-yl-4-keto-6-phenyl-1H-pyrimidin-5-yl)propionitrile Formula: C21H18N4O MolecularWeight: 342.39382

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C3=NC(=O)C(=C(N3)C4=CC=CC=C4)CCC#N

Isomeric SMILES

C1CN(C2=CC=CC=C21)C3=NC(=O)C(=C(N3)C4=CC=CC=C4)CCC#N

InChI

InChI=1S/C21H18N4O/c22-13-6-10-17-19(16-8-2-1-3-9-16)23-21(24-20(17)26)25-14-12-15-7-4-5-11-18(15)25/h1-5,7-9,11H,6,10,12,14H2,(H,23,24,26)