3-bromanyl-N-[[2-(cyclohexylcarbamoyl)phenyl]-methyl-carbamothioyl]-4-(2-methylpropoxy)benzamide

Systemtic Name: 3-bromanyl-N-[[2-(cyclohexylcarbamoyl)phenyl]-methyl-carbamothioyl]-4-(2-methylpropoxy)benzamide Openeye Name: 3-bromo-N-[[2-(cyclohexylcarbamoyl)phenyl]-methyl-carbamothioyl]-4-isobutoxy-benzamide CAS Name: 3-bromo-N-[[2-[(cyclohexylamino)-oxomethyl]-N-methylanilino]-sulfanylidenemethyl]-4-(2-methylpropoxy)benzamide IUPAC Name: 3-bromo-N-[[2-(cyclohexylcarbamoyl)phenyl]-methylcarbamothioyl]-4-(2-methylpropoxy)benzamide Traditional Name: 3-bromo-N-[[2-(cyclohexylcarbamoyl)phenyl]-methyl-thiocarbamoyl]-4-isobutoxy-benzamide Formula: C26H32BrN3O3S MolecularWeight: 546.51958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)NC3CCCCC3)Br

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)NC3CCCCC3)Br

InChI

InChI=1S/C26H32BrN3O3S/c1-17(2)16-33-23-14-13-18(15-21(23)27)24(31)29-26(34)30(3)22-12-8-7-11-20(22)25(32)28-19-9-5-4-6-10-19/h7-8,11-15,17,19H,4-6,9-10,16H2,1-3H3,(H,28,32)(H,29,31,34)