1-[(2-bromanylthiophen-3-yl)methyl]-3-[2-(1,3-thiazol-4-yl)-3H-benzimidazol-5-yl]urea

Systemtic Name: 1-[(2-bromanylthiophen-3-yl)methyl]-3-[2-(1,3-thiazol-4-yl)-3H-benzimidazol-5-yl]urea Openeye Name: 1-[(2-bromo-3-thienyl)methyl]-3-(2-thiazol-4-yl-3H-benzimidazol-5-yl)urea CAS Name: 1-[(2-bromo-3-thiophenyl)methyl]-3-[2-(4-thiazolyl)-3H-benzimidazol-5-yl]urea IUPAC Name: 1-[(2-bromothiophen-3-yl)methyl]-3-[2-(1,3-thiazol-4-yl)-3H-benzimidazol-5-yl]urea Traditional Name: 1-[(2-bromo-3-thienyl)methyl]-3-(2-thiazol-4-yl-3H-benzimidazol-5-yl)urea Formula: C16H12BrN5OS2 MolecularWeight: 434.33338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)NCC3=C(SC=C3)Br)NC(=N2)C4=CSC=N4

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)NCC3=C(SC=C3)Br)NC(=N2)C4=CSC=N4

InChI

InChI=1S/C16H12BrN5OS2/c17-14-9(3-4-25-14)6-18-16(23)20-10-1-2-11-12(5-10)22-15(21-11)13-7-24-8-19-13/h1-5,7-8H,6H2,(H,21,22)(H2,18,20,23)