[2-(aminocarbonylamino)-3-(2-aminocarbonylphenyl)-4-azanyl-4H-pyrimidin-5-yl] hydrogen carbonate

Systemtic Name: [2-(aminocarbonylamino)-3-(2-aminocarbonylphenyl)-4-azanyl-4H-pyrimidin-5-yl] hydrogen carbonate Openeye Name: [4-amino-3-(2-carbamoylphenyl)-2-ureido-4H-pyrimidin-5-yl] hydrogen carbonate CAS Name: carbonic acid [4-amino-2-(carbamoylamino)-3-(2-carbamoylphenyl)-4H-pyrimidin-5-yl] ester IUPAC Name: [4-amino-2-(carbamoylamino)-3-(2-carbamoylphenyl)-4H-pyrimidin-5-yl] hydrogen carbonate Traditional Name: carbonic acid [4-amino-3-(2-carbamoylphenyl)-2-ureido-4H-pyrimidin-5-yl] ester Formula: C13H14N6O5 MolecularWeight: 334.28746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N)N2C(C(=CN=C2NC(=O)N)OC(=O)O)N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N)N2C(C(=CN=C2NC(=O)N)OC(=O)O)N

InChI

InChI=1S/C13H14N6O5/c14-9-8(24-13(22)23)5-17-12(18-11(16)21)19(9)7-4-2-1-3-6(7)10(15)20/h1-5,9H,14H2,(H2,15,20)(H,22,23)(H3,16,17,18,21)