tert-butyl 4-[[[3-[(2-bromophenyl)carbamoylamino]-6-chloranyl-2-oxidanyl-phenyl]sulfonylamino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[[3-[(2-bromophenyl)carbamoylamino]-6-chloranyl-2-oxidanyl-phenyl]sulfonylamino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[[3-[(2-bromophenyl)carbamoylamino]-6-chloro-2-hydroxy-phenyl]sulfonylamino]methyl]piperidine-1-carboxylate CAS Name: 4-[[[3-[[(2-bromoanilino)-oxomethyl]amino]-6-chloro-2-hydroxyphenyl]sulfonylamino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[[3-[(2-bromophenyl)carbamoylamino]-6-chloro-2-hydroxyphenyl]sulfonylamino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[[3-[(2-bromophenyl)carbamoylamino]-6-chloro-2-hydroxy-phenyl]sulfonylamino]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H30BrClN4O6S MolecularWeight: 617.9402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CNS(=O)(=O)C2=C(C=CC(=C2O)NC(=O)NC3=CC=CC=C3Br)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CNS(=O)(=O)C2=C(C=CC(=C2O)NC(=O)NC3=CC=CC=C3Br)Cl

InChI

InChI=1S/C24H30BrClN4O6S/c1-24(2,3)36-23(33)30-12-10-15(11-13-30)14-27-37(34,35)21-17(26)8-9-19(20(21)31)29-22(32)28-18-7-5-4-6-16(18)25/h4-9,15,27,31H,10-14H2,1-3H3,(H2,28,29,32)