1-ethyl-2,4-bis(oxidanylidene)-3-[2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]pyrimidine-5-carbonitrile

Systemtic Name: 1-ethyl-2,4-bis(oxidanylidene)-3-[2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]pyrimidine-5-carbonitrile Openeye Name: 1-ethyl-2,4-dioxo-3-[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]pyrimidine-5-carbonitrile CAS Name: 1-ethyl-2,4-dioxo-3-[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]-5-pyrimidinecarbonitrile IUPAC Name: 1-ethyl-2,4-dioxo-3-[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]pyrimidine-5-carbonitrile Traditional Name: 1-ethyl-2,4-diketo-3-[2-keto-2-(3-phenyl-2-pyrazolin-1-yl)ethyl]pyrimidine-5-carbonitrile Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)N(C1=O)CC(=O)N2CCC(=N2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCN1C=C(C(=O)N(C1=O)CC(=O)N2CCC(=N2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C18H17N5O3/c1-2-21-11-14(10-19)17(25)22(18(21)26)12-16(24)23-9-8-15(20-23)13-6-4-3-5-7-13/h3-7,11H,2,8-9,12H2,1H3