N-[[3-[(4-bromophenyl)sulfamoyl]-4-methyl-phenyl]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[3-[(4-bromophenyl)sulfamoyl]-4-methyl-phenyl]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[3-[(4-bromophenyl)sulfamoyl]-4-methyl-phenyl]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[3-[(4-bromophenyl)sulfamoyl]-4-methylanilino]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[3-[(4-bromophenyl)sulfamoyl]-4-methylphenyl]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[3-[(4-bromophenyl)sulfamoyl]-4-methyl-phenyl]thiocarbamoyl]cyclohexanecarboxamide Formula: C21H24BrN3O3S2 MolecularWeight: 510.46756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2CCCCC2)S(=O)(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2CCCCC2)S(=O)(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H24BrN3O3S2/c1-14-7-10-18(23-21(29)24-20(26)15-5-3-2-4-6-15)13-19(14)30(27,28)25-17-11-8-16(22)9-12-17/h7-13,15,25H,2-6H2,1H3,(H2,23,24,26,29)