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

Systemtic Name: 1-ethyl-3-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 1-ethyl-3-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxo-ethyl]-2,4-dioxo-pyrimidine-5-carbonitrile CAS Name: 1-ethyl-3-[2-[4-(2-nitrophenyl)-1-piperazinyl]-2-oxoethyl]-2,4-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 1-ethyl-3-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxoethyl]-2,4-dioxopyrimidine-5-carbonitrile Traditional Name: 1-ethyl-2,4-diketo-3-[2-keto-2-[4-(2-nitrophenyl)piperazino]ethyl]pyrimidine-5-carbonitrile Formula: C19H20N6O5 MolecularWeight: 412.3993

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)N(C1=O)CC(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])C#N

Isomeric SMILES

CCN1C=C(C(=O)N(C1=O)CC(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])C#N

InChI

InChI=1S/C19H20N6O5/c1-2-21-12-14(11-20)18(27)24(19(21)28)13-17(26)23-9-7-22(8-10-23)15-5-3-4-6-16(15)25(29)30/h3-6,12H,2,7-10,13H2,1H3