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

Systemtic Name: 3-bromanyl-N-[[2-(cyclohexylcarbamoyl)phenyl]-methyl-carbamothioyl]-4-(2-methoxyethoxy)benzamide Openeye Name: 3-bromo-N-[[2-(cyclohexylcarbamoyl)phenyl]-methyl-carbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: 3-bromo-N-[[2-[(cyclohexylamino)-oxomethyl]-N-methylanilino]-sulfanylidenemethyl]-4-(2-methoxyethoxy)benzamide IUPAC Name: 3-bromo-N-[[2-(cyclohexylcarbamoyl)phenyl]-methylcarbamothioyl]-4-(2-methoxyethoxy)benzamide Traditional Name: 3-bromo-N-[[2-(cyclohexylcarbamoyl)phenyl]-methyl-thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C25H30BrN3O4S MolecularWeight: 548.4924

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NC2CCCCC2)C(=S)NC(=O)C3=CC(=C(C=C3)OCCOC)Br

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NC2CCCCC2)C(=S)NC(=O)C3=CC(=C(C=C3)OCCOC)Br

InChI

InChI=1S/C25H30BrN3O4S/c1-29(21-11-7-6-10-19(21)24(31)27-18-8-4-3-5-9-18)25(34)28-23(30)17-12-13-22(20(26)16-17)33-15-14-32-2/h6-7,10-13,16,18H,3-5,8-9,14-15H2,1-2H3,(H,27,31)(H,28,30,34)