6-(4-fluorophenyl)-2-(3-imidazolidin-1-ylpropylamino)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-fluorophenyl)-2-(3-imidazolidin-1-ylpropylamino)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(4-fluorophenyl)-2-(3-imidazolidin-1-ylpropylamino)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-fluorophenyl)-2-[3-(1-imidazolidinyl)propylamino]-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-fluorophenyl)-2-(3-imidazolidin-1-ylpropylamino)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(4-fluorophenyl)-2-(3-imidazolidin-1-ylpropylamino)-4-keto-1H-pyrimidine-5-carbonitrile Formula: C17H19FN6O MolecularWeight: 342.370763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CN1)CCCNC2=NC(=O)C(=C(N2)C3=CC=C(C=C3)F)C#N

Isomeric SMILES

C1CN(CN1)CCCNC2=NC(=O)C(=C(N2)C3=CC=C(C=C3)F)C#N

InChI

InChI=1S/C17H19FN6O/c18-13-4-2-12(3-5-13)15-14(10-19)16(25)23-17(22-15)21-6-1-8-24-9-7-20-11-24/h2-5,20H,1,6-9,11H2,(H2,21,22,23,25)