methyl 4-[(5-chloranyl-2-methylsulfonyl-pyrimidin-4-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(5-chloranyl-2-methylsulfonyl-pyrimidin-4-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(5-chloro-2-methylsulfonyl-pyrimidine-4-carbonyl)amino]benzoate CAS Name: 4-[[(5-chloro-2-methylsulfonyl-4-pyrimidinyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-chloro-2-methylsulfonylpyrimidine-4-carbonyl)amino]benzoate Traditional Name: 4-[(5-chloro-2-mesyl-pyrimidine-4-carbonyl)amino]benzoic acid methyl ester Formula: C14H12ClN3O5S MolecularWeight: 369.78018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)S(=O)(=O)C

InChI

InChI=1S/C14H12ClN3O5S/c1-23-13(20)8-3-5-9(6-4-8)17-12(19)11-10(15)7-16-14(18-11)24(2,21)22/h3-7H,1-2H3,(H,17,19)