ethyl 2-[3-[(5-ethoxycarbonyl-6-oxidanylidene-1H-pyrimidin-2-yl)amino]propylamino]-6-oxidanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[3-[(5-ethoxycarbonyl-6-oxidanylidene-1H-pyrimidin-2-yl)amino]propylamino]-6-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-[3-[(5-ethoxycarbonyl-6-oxo-1H-pyrimidin-2-yl)amino]propylamino]-6-oxo-1H-pyrimidine-5-carboxylate CAS Name: 2-[3-[(5-ethoxycarbonyl-6-oxo-1H-pyrimidin-2-yl)amino]propylamino]-6-oxo-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-[(5-ethoxycarbonyl-6-oxo-1H-pyrimidin-2-yl)amino]propylamino]-6-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 2-[3-[(5-carbethoxy-6-keto-1H-pyrimidin-2-yl)amino]propylamino]-6-keto-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C17H22N6O6 MolecularWeight: 406.39318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(NC1=O)NCCCNC2=NC=C(C(=O)N2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CN=C(NC1=O)NCCCNC2=NC=C(C(=O)N2)C(=O)OCC

InChI

InChI=1S/C17H22N6O6/c1-3-28-14(26)10-8-20-16(22-12(10)24)18-6-5-7-19-17-21-9-11(13(25)23-17)15(27)29-4-2/h8-9H,3-7H2,1-2H3,(H2,18,20,22,24)(H2,19,21,23,25)