[2-[[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-methyl-amino]-2-oxidanylidene-ethyl] 3-(1H-benzimidazol-2-yl)propanoate

Systemtic Name: [2-[[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-methyl-amino]-2-oxidanylidene-ethyl] 3-(1H-benzimidazol-2-yl)propanoate Openeye Name: [2-[(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-methyl-amino]-2-oxo-ethyl] 3-(1H-benzimidazol-2-yl)propanoate CAS Name: 3-(1H-benzimidazol-2-yl)propanoic 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] 3-(1H-benzimidazol-2-yl)propanoate Traditional Name: 3-(1H-benzimidazol-2-yl)propionic acid [2-[(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-methyl-amino]-2-keto-ethyl] ester Formula: C24H24N6O5 MolecularWeight: 476.48456

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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)CCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)COC(=O)CCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C24H24N6O5/c1-29(21-22(25)30(24(34)28-23(21)33)13-15-7-3-2-4-8-15)19(31)14-35-20(32)12-11-18-26-16-9-5-6-10-17(16)27-18/h2-10H,11-14,25H2,1H3,(H,26,27)(H,28,33,34)