N-[[(2-bromophenyl)carbonylamino]carbamothioyl]-4-butoxy-benzamide

Systemtic Name: N-[[(2-bromophenyl)carbonylamino]carbamothioyl]-4-butoxy-benzamide Openeye Name: N-[[(2-bromobenzoyl)amino]carbamothioyl]-4-butoxy-benzamide CAS Name: N-[[[(2-bromophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-butoxybenzamide IUPAC Name: N-[[(2-bromobenzoyl)amino]carbamothioyl]-4-butoxybenzamide Traditional Name: N-[[(2-bromobenzoyl)amino]thiocarbamoyl]-4-butoxy-benzamide Formula: C19H20BrN3O3S MolecularWeight: 450.3494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C19H20BrN3O3S/c1-2-3-12-26-14-10-8-13(9-11-14)17(24)21-19(27)23-22-18(25)15-6-4-5-7-16(15)20/h4-11H,2-3,12H2,1H3,(H,22,25)(H2,21,23,24,27)