4-[4-[6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 4-[4-[6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 4-[4-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)piperazin-1-yl]benzonitrile CAS Name: 4-[4-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-1-piperazinyl]benzonitrile IUPAC Name: 4-[4-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)piperazin-1-yl]benzonitrile Traditional Name: 4-[4-(2,4-diketo-6-methyl-1H-pyrimidin-5-yl)piperazino]benzonitrile Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=O)N1)N2CCN(CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=O)N1)N2CCN(CC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H17N5O2/c1-11-14(15(22)19-16(23)18-11)21-8-6-20(7-9-21)13-4-2-12(10-17)3-5-13/h2-5H,6-9H2,1H3,(H2,18,19,22,23)