[2-[[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-(2-methoxyethyl)amino]-2-oxidanylidene-ethyl] 2,4-dimethylbenzoate

Systemtic Name: [2-[[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-(2-methoxyethyl)amino]-2-oxidanylidene-ethyl] 2,4-dimethylbenzoate Openeye Name: [2-[(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-(2-methoxyethyl)amino]-2-oxo-ethyl] 2,4-dimethylbenzoate CAS Name: 2,4-dimethylbenzoic acid [2-[(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-(2-methoxyethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-(2-methoxyethyl)amino]-2-oxoethyl] 2,4-dimethylbenzoate Traditional Name: 2,4-dimethylbenzoic acid [2-[(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-(2-methoxyethyl)amino]-2-keto-ethyl] ester Formula: C21H28N4O6 MolecularWeight: 432.47022

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)COC(=O)C2=C(C=C(C=C2)C)C)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)COC(=O)C2=C(C=C(C=C2)C)C)N

InChI

InChI=1S/C21H28N4O6/c1-5-8-25-18(22)17(19(27)23-21(25)29)24(9-10-30-4)16(26)12-31-20(28)15-7-6-13(2)11-14(15)3/h6-7,11H,5,8-10,12,22H2,1-4H3,(H,23,27,29)