N-(2-aminophenyl)-4-[(5-bromanyl-2-sulfanylidene-3H-benzimidazol-1-yl)methyl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[(5-bromanyl-2-sulfanylidene-3H-benzimidazol-1-yl)methyl]benzamide Openeye Name: N-(2-aminophenyl)-4-[(5-bromo-2-thioxo-3H-benzimidazol-1-yl)methyl]benzamide CAS Name: N-(2-aminophenyl)-4-[(5-bromo-2-sulfanylidene-3H-benzimidazol-1-yl)methyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[(5-bromo-2-sulfanylidene-3H-benzimidazol-1-yl)methyl]benzamide Traditional Name: N-(2-aminophenyl)-4-[(5-bromo-2-thioxo-3H-benzimidazol-1-yl)methyl]benzamide Formula: C21H17BrN4OS MolecularWeight: 453.35488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CN3C4=C(C=C(C=C4)Br)NC3=S

Isomeric SMILES

C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CN3C4=C(C=C(C=C4)Br)NC3=S

InChI

InChI=1S/C21H17BrN4OS/c22-15-9-10-19-18(11-15)25-21(28)26(19)12-13-5-7-14(8-6-13)20(27)24-17-4-2-1-3-16(17)23/h1-11H,12,23H2,(H,24,27)(H,25,28)