N-[[(3-bromanyl-4-methyl-phenyl)carbonylamino]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[(3-bromanyl-4-methyl-phenyl)carbonylamino]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[(3-bromo-4-methyl-benzoyl)amino]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[[(3-bromo-4-methylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[(3-bromo-4-methyl-benzoyl)amino]thiocarbamoyl]cyclohexanecarboxamide Formula: C16H20BrN3O2S MolecularWeight: 398.3179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2CCCCC2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2CCCCC2)Br

InChI

InChI=1S/C16H20BrN3O2S/c1-10-7-8-12(9-13(10)17)15(22)19-20-16(23)18-14(21)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,19,22)(H2,18,20,21,23)