[2-[(4-butan-2-ylphenyl)amino]-2-oxidanylidene-ethyl] 2-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]ethanoate

Systemtic Name: [2-[(4-butan-2-ylphenyl)amino]-2-oxidanylidene-ethyl] 2-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]ethanoate Openeye Name: [2-oxo-2-(4-sec-butylanilino)ethyl] 2-[(4-bromo-2-chloro-phenyl)sulfonylamino]acetate CAS Name: 2-[(4-bromo-2-chlorophenyl)sulfonylamino]acetic acid [2-(4-butan-2-ylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-butan-2-ylanilino)-2-oxoethyl] 2-[(4-bromo-2-chlorophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-bromo-2-chloro-phenyl)sulfonylamino]acetic acid [2-keto-2-(4-sec-butylanilino)ethyl] ester Formula: C20H22BrClN2O5S MolecularWeight: 517.82108

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)COC(=O)CNS(=O)(=O)C2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)COC(=O)CNS(=O)(=O)C2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C20H22BrClN2O5S/c1-3-13(2)14-4-7-16(8-5-14)24-19(25)12-29-20(26)11-23-30(27,28)18-9-6-15(21)10-17(18)22/h4-10,13,23H,3,11-12H2,1-2H3,(H,24,25)