2-[[4-azido-5-(2-ethoxyethyl)-6-phenyl-pyrimidin-2-yl]carbamoylamino]ethanoic acid

Systemtic Name: 2-[[4-azido-5-(2-ethoxyethyl)-6-phenyl-pyrimidin-2-yl]carbamoylamino]ethanoic acid Openeye Name: 2-[[4-azido-5-(2-ethoxyethyl)-6-phenyl-pyrimidin-2-yl]carbamoylamino]acetic acid CAS Name: 2-[[[[4-azido-5-(2-ethoxyethyl)-6-phenyl-2-pyrimidinyl]amino]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[4-azido-5-(2-ethoxyethyl)-6-phenylpyrimidin-2-yl]carbamoylamino]acetic acid Traditional Name: 2-[[4-azido-5-(2-ethoxyethyl)-6-phenyl-pyrimidin-2-yl]carbamoylamino]acetic acid Formula: C17H19N7O4 MolecularWeight: 385.37726

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC1=C(N=C(N=C1N=[N+]=[N-])NC(=O)NCC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCOCCC1=C(N=C(N=C1N=[N+]=[N-])NC(=O)NCC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C17H19N7O4/c1-2-28-9-8-12-14(11-6-4-3-5-7-11)20-16(21-15(12)23-24-18)22-17(27)19-10-13(25)26/h3-7H,2,8-10H2,1H3,(H,25,26)(H2,19,20,21,22,27)