4-bromanyl-N-[2,5-dimethoxy-4-(methylcarbamothioylamino)phenyl]benzamide

Systemtic Name: 4-bromanyl-N-[2,5-dimethoxy-4-(methylcarbamothioylamino)phenyl]benzamide Openeye Name: 4-bromo-N-[2,5-dimethoxy-4-(methylcarbamothioylamino)phenyl]benzamide CAS Name: 4-bromo-N-[2,5-dimethoxy-4-[[methylamino(sulfanylidene)methyl]amino]phenyl]benzamide IUPAC Name: 4-bromo-N-[2,5-dimethoxy-4-(methylcarbamothioylamino)phenyl]benzamide Traditional Name: 4-bromo-N-[2,5-dimethoxy-4-(methylthiocarbamoylamino)phenyl]benzamide Formula: C17H18BrN3O3S MolecularWeight: 424.31212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=C(C=C(C(=C1)OC)NC(=O)C2=CC=C(C=C2)Br)OC

Isomeric SMILES

CNC(=S)NC1=C(C=C(C(=C1)OC)NC(=O)C2=CC=C(C=C2)Br)OC

InChI

InChI=1S/C17H18BrN3O3S/c1-19-17(25)21-13-9-14(23-2)12(8-15(13)24-3)20-16(22)10-4-6-11(18)7-5-10/h4-9H,1-3H3,(H,20,22)(H2,19,21,25)