4-[[3-methyl-2,4-bis(oxidanylidene)-6-pyrrolidin-1-yl-1H-pyrimidin-5-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[3-methyl-2,4-bis(oxidanylidene)-6-pyrrolidin-1-yl-1H-pyrimidin-5-yl]methyl]benzenecarbonitrile Openeye Name: 4-[(3-methyl-2,4-dioxo-6-pyrrolidin-1-yl-1H-pyrimidin-5-yl)methyl]benzonitrile CAS Name: 4-[[3-methyl-2,4-dioxo-6-(1-pyrrolidinyl)-1H-pyrimidin-5-yl]methyl]benzonitrile IUPAC Name: 4-[(3-methyl-2,4-dioxo-6-pyrrolidin-1-yl-1H-pyrimidin-5-yl)methyl]benzonitrile Traditional Name: 4-[(2,4-diketo-3-methyl-6-pyrrolidino-1H-pyrimidin-5-yl)methyl]benzonitrile Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(NC1=O)N2CCCC2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CN1C(=O)C(=C(NC1=O)N2CCCC2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H18N4O2/c1-20-16(22)14(10-12-4-6-13(11-18)7-5-12)15(19-17(20)23)21-8-2-3-9-21/h4-7H,2-3,8-10H2,1H3,(H,19,23)