6-(4-dimethylaminophenyl)-4-oxidanylidene-2-(4-phenylpiperazin-1-yl)-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-dimethylaminophenyl)-4-oxidanylidene-2-(4-phenylpiperazin-1-yl)-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(4-dimethylaminophenyl)-4-oxo-2-(4-phenylpiperazin-1-yl)-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-dimethylaminophenyl)-4-oxo-2-(4-phenyl-1-piperazinyl)-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-dimethylaminophenyl)-4-oxo-2-(4-phenylpiperazin-1-yl)-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(4-dimethylaminophenyl)-4-keto-2-(4-phenylpiperazino)-1H-pyrimidine-5-carbonitrile Formula: C23H24N6O MolecularWeight: 400.47626

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)N3CCN(CC3)C4=CC=CC=C4)C#N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)N3CCN(CC3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C23H24N6O/c1-27(2)18-10-8-17(9-11-18)21-20(16-24)22(30)26-23(25-21)29-14-12-28(13-15-29)19-6-4-3-5-7-19/h3-11H,12-15H2,1-2H3,(H,25,26,30)