methyl 2-[[(4,6-dimethoxypyrimidin-2-yl)carbamoylamino]-sulfonyl-methyl]benzoate

Systemtic Name: methyl 2-[[(4,6-dimethoxypyrimidin-2-yl)carbamoylamino]-sulfonyl-methyl]benzoate Openeye Name: methyl 2-[[(4,6-dimethoxypyrimidin-2-yl)carbamoylamino]-sulfonyl-methyl]benzoate CAS Name: 2-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]-oxomethyl]amino]-sulfonylmethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[(4,6-dimethoxypyrimidin-2-yl)carbamoylamino]-sulfonylmethyl]benzoate Traditional Name: 2-[[(4,6-dimethoxypyrimidin-2-yl)carbamoylamino]-sulfonyl-methyl]benzoic acid methyl ester Formula: C16H16N4O7S MolecularWeight: 408.38584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)NC(=S(=O)=O)C2=CC=CC=C2C(=O)OC)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)NC(=S(=O)=O)C2=CC=CC=C2C(=O)OC)OC

InChI

InChI=1S/C16H16N4O7S/c1-25-11-8-12(26-2)18-15(17-11)20-16(22)19-13(28(23)24)9-6-4-5-7-10(9)14(21)27-3/h4-8H,1-3H3,(H2,17,18,19,20,22)