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

Systemtic Name: 1-ethyl-2,4-bis(oxidanylidene)-3-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]pyrimidine-5-carbonitrile Openeye Name: 3-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]-1-ethyl-2,4-dioxo-pyrimidine-5-carbonitrile CAS Name: 1-ethyl-2,4-dioxo-3-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-5-pyrimidinecarbonitrile IUPAC Name: 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-1-ethyl-2,4-dioxopyrimidine-5-carbonitrile Traditional Name: 3-[2-(4-benzylpiperidino)-2-keto-ethyl]-1-ethyl-2,4-diketo-pyrimidine-5-carbonitrile Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)N(C1=O)CC(=O)N2CCC(CC2)CC3=CC=CC=C3)C#N

Isomeric SMILES

CCN1C=C(C(=O)N(C1=O)CC(=O)N2CCC(CC2)CC3=CC=CC=C3)C#N

InChI

InChI=1S/C21H24N4O3/c1-2-23-14-18(13-22)20(27)25(21(23)28)15-19(26)24-10-8-17(9-11-24)12-16-6-4-3-5-7-16/h3-7,14,17H,2,8-12,15H2,1H3