4-[2-(3-bromophenyl)ethylcarbamothioylamino]benzamide

Systemtic Name: 4-[2-(3-bromophenyl)ethylcarbamothioylamino]benzamide Openeye Name: 4-[2-(3-bromophenyl)ethylcarbamothioylamino]benzamide CAS Name: 4-[[[2-(3-bromophenyl)ethylamino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: 4-[2-(3-bromophenyl)ethylcarbamothioylamino]benzamide Traditional Name: 4-[2-(3-bromophenyl)ethylthiocarbamoylamino]benzamide Formula: C16H16BrN3OS MolecularWeight: 378.28674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CCNC(=S)NC2=CC=C(C=C2)C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)Br)CCNC(=S)NC2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C16H16BrN3OS/c17-13-3-1-2-11(10-13)8-9-19-16(22)20-14-6-4-12(5-7-14)15(18)21/h1-7,10H,8-9H2,(H2,18,21)(H2,19,20,22)