(5-ethanoyl-2-methoxy-phenyl)methyl 4-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-pentyl-amino]-4-oxidanylidene-butanoate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 4-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-pentyl-amino]-4-oxidanylidene-butanoate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 4-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-pentyl-amino]-4-oxo-butanoate CAS Name: 4-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-pentylamino]-4-oxobutanoic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 4-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-pentylamino]-4-oxobutanoate Traditional Name: 4-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-amyl-amino]-4-keto-butyric acid (5-acetyl-2-methoxy-benzyl) ester Formula: C27H38N4O7 MolecularWeight: 530.61322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=O)CCC(=O)OCC2=C(C=CC(=C2)C(=O)C)OC

Isomeric SMILES

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=O)CCC(=O)OCC2=C(C=CC(=C2)C(=O)C)OC

InChI

InChI=1S/C27H38N4O7/c1-5-7-9-15-30(24-25(28)31(14-8-6-2)27(36)29-26(24)35)22(33)12-13-23(34)38-17-20-16-19(18(3)32)10-11-21(20)37-4/h10-11,16H,5-9,12-15,17,28H2,1-4H3,(H,29,35,36)