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

Systemtic Name: [2-[[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-ethyl-amino]-2-oxidanylidene-ethyl] butanoate Openeye Name: [2-[(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-ethyl-amino]-2-oxo-ethyl] butanoate CAS Name: butanoic acid [2-[[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-ethylamino]-2-oxoethyl] butanoate Traditional Name: butyric acid [2-[(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-ethyl-amino]-2-keto-ethyl] ester Formula: C19H24N4O5 MolecularWeight: 388.41766

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(=O)N(CC)C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N

Isomeric SMILES

CCCC(=O)OCC(=O)N(CC)C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N

InChI

InChI=1S/C19H24N4O5/c1-3-8-15(25)28-12-14(24)22(4-2)16-17(20)23(19(27)21-18(16)26)11-13-9-6-5-7-10-13/h5-7,9-10H,3-4,8,11-12,20H2,1-2H3,(H,21,26,27)