ethyl 2-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]piperazin-1-yl]-4-phenyl-butanoate

Systemtic Name: ethyl 2-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]piperazin-1-yl]-4-phenyl-butanoate Openeye Name: ethyl 2-[4-(1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)piperazin-1-yl]-4-phenyl-butanoate CAS Name: 2-[4-(1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-1-piperazinyl]-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 2-[4-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperazin-1-yl]-4-phenylbutanoate Traditional Name: 2-[4-(2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)piperazino]-4-phenyl-butyric acid ethyl ester Formula: C22H30N4O4 MolecularWeight: 414.498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)N2CCN(CC2)C3=CC(=O)N(C(=O)N3C)C

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)N2CCN(CC2)C3=CC(=O)N(C(=O)N3C)C

InChI

InChI=1S/C22H30N4O4/c1-4-30-21(28)18(11-10-17-8-6-5-7-9-17)25-12-14-26(15-13-25)19-16-20(27)24(3)22(29)23(19)2/h5-9,16,18H,4,10-15H2,1-3H3