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

Systemtic Name: N-[[(3-bromanyl-4-methyl-phenyl)carbonylamino]carbamothioyl]cyclopropanecarboxamide Openeye Name: N-[[(3-bromo-4-methyl-benzoyl)amino]carbamothioyl]cyclopropanecarboxamide CAS Name: N-[[[(3-bromo-4-methylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]cyclopropanecarboxamide IUPAC Name: N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]cyclopropanecarboxamide Traditional Name: N-[[(3-bromo-4-methyl-benzoyl)amino]thiocarbamoyl]cyclopropanecarboxamide Formula: C13H14BrN3O2S MolecularWeight: 356.23816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2CC2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2CC2)Br

InChI

InChI=1S/C13H14BrN3O2S/c1-7-2-3-9(6-10(7)14)12(19)16-17-13(20)15-11(18)8-4-5-8/h2-3,6,8H,4-5H2,1H3,(H,16,19)(H2,15,17,18,20)