N-[2-[(2-bromophenyl)sulfonyl-(methylcarbamothioyl)amino]ethyl]-5-tert-butyl-2-methoxy-benzamide

Systemtic Name: N-[2-[(2-bromophenyl)sulfonyl-(methylcarbamothioyl)amino]ethyl]-5-tert-butyl-2-methoxy-benzamide Openeye Name: N-[2-[(2-bromophenyl)sulfonyl-(methylcarbamothioyl)amino]ethyl]-5-tert-butyl-2-methoxy-benzamide CAS Name: N-[2-[(2-bromophenyl)sulfonyl-[methylamino(sulfanylidene)methyl]amino]ethyl]-5-tert-butyl-2-methoxybenzamide IUPAC Name: N-[2-[(2-bromophenyl)sulfonyl-(methylcarbamothioyl)amino]ethyl]-5-tert-butyl-2-methoxybenzamide Traditional Name: N-[2-[(2-bromophenyl)sulfonyl-(methylthiocarbamoyl)amino]ethyl]-5-tert-butyl-2-methoxy-benzamide Formula: C22H28BrN3O4S2 MolecularWeight: 542.50942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)C(=O)NCCN(C(=S)NC)S(=O)(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)C(=O)NCCN(C(=S)NC)S(=O)(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C22H28BrN3O4S2/c1-22(2,3)15-10-11-18(30-5)16(14-15)20(27)25-12-13-26(21(31)24-4)32(28,29)19-9-7-6-8-17(19)23/h6-11,14H,12-13H2,1-5H3,(H,24,31)(H,25,27)