6-(4-methoxyphenyl)-4-oxidanylidene-2-(2-phenylpyrrolidin-1-yl)-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)-4-oxidanylidene-2-(2-phenylpyrrolidin-1-yl)-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(4-methoxyphenyl)-4-oxo-2-(2-phenylpyrrolidin-1-yl)-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-methoxyphenyl)-4-oxo-2-(2-phenyl-1-pyrrolidinyl)-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-methoxyphenyl)-4-oxo-2-(2-phenylpyrrolidin-1-yl)-1H-pyrimidine-5-carbonitrile Traditional Name: 4-keto-6-(4-methoxyphenyl)-2-(2-phenylpyrrolidino)-1H-pyrimidine-5-carbonitrile Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)N3CCCC3C4=CC=CC=C4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)N3CCCC3C4=CC=CC=C4)C#N

InChI

InChI=1S/C22H20N4O2/c1-28-17-11-9-16(10-12-17)20-18(14-23)21(27)25-22(24-20)26-13-5-8-19(26)15-6-3-2-4-7-15/h2-4,6-7,9-12,19H,5,8,13H2,1H3,(H,24,25,27)