butyl 4-[(5-chloranyl-2-ethylsulfonyl-pyrimidin-4-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(5-chloranyl-2-ethylsulfonyl-pyrimidin-4-yl)carbonylamino]benzoate Openeye Name: butyl 4-[(5-chloro-2-ethylsulfonyl-pyrimidine-4-carbonyl)amino]benzoate CAS Name: 4-[[(5-chloro-2-ethylsulfonyl-4-pyrimidinyl)-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(5-chloro-2-ethylsulfonylpyrimidine-4-carbonyl)amino]benzoate Traditional Name: 4-[(5-chloro-2-esyl-pyrimidine-4-carbonyl)amino]benzoic acid butyl ester Formula: C18H20ClN3O5S MolecularWeight: 425.8865

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O5S/c1-3-5-10-27-17(24)12-6-8-13(9-7-12)21-16(23)15-14(19)11-20-18(22-15)28(25,26)4-2/h6-9,11H,3-5,10H2,1-2H3,(H,21,23)