methyl 2-[2-[4-(2-carbamimidoylpyrimidin-5-yl)phenoxy]ethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-[4-(2-carbamimidoylpyrimidin-5-yl)phenoxy]ethanoylamino]ethanoate Openeye Name: methyl 2-[[2-[4-(2-carbamimidoylpyrimidin-5-yl)phenoxy]acetyl]amino]acetate CAS Name: 2-[[2-[4-(2-carbamimidoyl-5-pyrimidinyl)phenoxy]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[4-(2-carbamimidoylpyrimidin-5-yl)phenoxy]acetyl]amino]acetate Traditional Name: 2-[[2-[4-(2-amidinopyrimidin-5-yl)phenoxy]acetyl]amino]acetic acid methyl ester Formula: C16H17N5O4 MolecularWeight: 343.33728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)COC1=CC=C(C=C1)C2=CN=C(N=C2)C(=N)N

Isomeric SMILES

COC(=O)CNC(=O)COC1=CC=C(C=C1)C2=CN=C(N=C2)C(=N)N

InChI

InChI=1S/C16H17N5O4/c1-24-14(23)8-19-13(22)9-25-12-4-2-10(3-5-12)11-6-20-16(15(17)18)21-7-11/h2-7H,8-9H2,1H3,(H3,17,18)(H,19,22)