ethyl 2-[(5-chloranyl-2-ethylsulfonyl-pyrimidin-4-yl)carbonylamino]-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(5-chloranyl-2-ethylsulfonyl-pyrimidin-4-yl)carbonylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(5-chloro-2-ethylsulfonyl-pyrimidine-4-carbonyl)amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[(5-chloro-2-ethylsulfonyl-4-pyrimidinyl)-oxomethyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-chloro-2-ethylsulfonylpyrimidine-4-carbonyl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[(5-chloro-2-esyl-pyrimidine-4-carbonyl)amino]-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C21H20ClN3O5S2 MolecularWeight: 493.9836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)C3=NC(=NC=C3Cl)S(=O)(=O)CC

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)C3=NC(=NC=C3Cl)S(=O)(=O)CC

InChI

InChI=1S/C21H20ClN3O5S2/c1-4-30-20(27)16-14(13-8-6-12(3)7-9-13)11-31-19(16)25-18(26)17-15(22)10-23-21(24-17)32(28,29)5-2/h6-11H,4-5H2,1-3H3,(H,25,26)