sulfonylmethyl 3-[(4,6-dimethoxypyrimidin-2-yl)carbamoylamino]-2-methyl-benzoate

Systemtic Name: sulfonylmethyl 3-[(4,6-dimethoxypyrimidin-2-yl)carbamoylamino]-2-methyl-benzoate Openeye Name: sulfonylmethyl 3-[(4,6-dimethoxypyrimidin-2-yl)carbamoylamino]-2-methyl-benzoate CAS Name: 3-[[[(4,6-dimethoxy-2-pyrimidinyl)amino]-oxomethyl]amino]-2-methylbenzoic acid sulfonylmethyl ester IUPAC Name: sulfonylmethyl 3-[(4,6-dimethoxypyrimidin-2-yl)carbamoylamino]-2-methylbenzoate Traditional Name: 3-[(4,6-dimethoxypyrimidin-2-yl)carbamoylamino]-2-methyl-benzoic acid sulfonylmethyl ester Formula: C16H16N4O7S MolecularWeight: 408.38584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)NC2=NC(=CC(=N2)OC)OC)C(=O)OC=S(=O)=O

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)NC2=NC(=CC(=N2)OC)OC)C(=O)OC=S(=O)=O

InChI

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