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

Systemtic Name: [2-[[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-methyl-amino]-2-oxidanylidene-ethyl] cyclopentanecarboxylate Openeye Name: [2-[(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-methyl-amino]-2-oxo-ethyl] cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid [2-[[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-methylamino]-2-oxoethyl] cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [2-[(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-methyl-amino]-2-keto-ethyl] ester Formula: C20H24N4O5 MolecularWeight: 400.42836

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)COC(=O)C3CCCC3

Isomeric SMILES

CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)COC(=O)C3CCCC3

InChI

InChI=1S/C20H24N4O5/c1-23(15(25)12-29-19(27)14-9-5-6-10-14)16-17(21)24(20(28)22-18(16)26)11-13-7-3-2-4-8-13/h2-4,7-8,14H,5-6,9-12,21H2,1H3,(H,22,26,28)