[2-[4-azanyl-1-ethyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-5-yl]-2-oxidanylidene-ethyl] butanoate

Systemtic Name: [2-[4-azanyl-1-ethyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-5-yl]-2-oxidanylidene-ethyl] butanoate Openeye Name: [2-(6-amino-1-benzyl-3-ethyl-2,4-dioxo-pyrimidin-5-yl)-2-oxo-ethyl] butanoate CAS Name: butanoic acid [2-[4-amino-1-ethyl-2,6-dioxo-3-(phenylmethyl)-5-pyrimidinyl]-2-oxoethyl] ester IUPAC Name: [2-(6-amino-1-benzyl-3-ethyl-2,4-dioxopyrimidin-5-yl)-2-oxoethyl] butanoate Traditional Name: butyric acid [2-(6-amino-1-benzyl-3-ethyl-2,4-diketo-pyrimidin-5-yl)-2-keto-ethyl] ester Formula: C19H23N3O5 MolecularWeight: 373.40302

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(=O)C1=C(N(C(=O)N(C1=O)CC)CC2=CC=CC=C2)N

Isomeric SMILES

CCCC(=O)OCC(=O)C1=C(N(C(=O)N(C1=O)CC)CC2=CC=CC=C2)N

InChI

InChI=1S/C19H23N3O5/c1-3-8-15(24)27-12-14(23)16-17(20)22(11-13-9-6-5-7-10-13)19(26)21(4-2)18(16)25/h5-7,9-10H,3-4,8,11-12,20H2,1-2H3