methyl 2-[[(Z)-N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-phenylmethoxy-sulfamoyl]benzoate

Systemtic Name: methyl 2-[[(Z)-N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-phenylmethoxy-sulfamoyl]benzoate Openeye Name: methyl 2-[benzyloxy-[(Z)-N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]sulfamoyl]benzoate CAS Name: 2-[[(Z)-amino-[(4,6-dimethyl-2-pyrimidinyl)imino]methyl]-phenylmethoxysulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[(Z)-N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-phenylmethoxysulfamoyl]benzoate Traditional Name: 2-[benzoxy-[(Z)-N'-(4,6-dimethylpyrimidin-2-yl)amidino]sulfamoyl]benzoic acid methyl ester Formula: C22H23N5O5S MolecularWeight: 469.51352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N=C(N)N(OCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3C(=O)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)/N=C(/N)\N(OCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3C(=O)OC)C

InChI

InChI=1S/C22H23N5O5S/c1-15-13-16(2)25-22(24-15)26-21(23)27(32-14-17-9-5-4-6-10-17)33(29,30)19-12-8-7-11-18(19)20(28)31-3/h4-13H,14H2,1-3H3,(H2,23,24,25,26)