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

Systemtic Name: 6-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-dimethylaminophenyl)-2-(4-methyl-1-piperazinyl)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(4-dimethylaminophenyl)-4-keto-2-(4-methylpiperazino)-1H-pyrimidine-5-carbonitrile Formula: C18H22N6O MolecularWeight: 338.40688

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=O)C(=C(N2)C3=CC=C(C=C3)N(C)C)C#N

Isomeric SMILES

CN1CCN(CC1)C2=NC(=O)C(=C(N2)C3=CC=C(C=C3)N(C)C)C#N

InChI

InChI=1S/C18H22N6O/c1-22(2)14-6-4-13(5-7-14)16-15(12-19)17(25)21-18(20-16)24-10-8-23(3)9-11-24/h4-7H,8-11H2,1-3H3,(H,20,21,25)