N-(6-bromanyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(6-bromanyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(6-bromo-2-keto-1,3-dihydrobenzimidazol-5-yl)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C20H17BrN6O2S MolecularWeight: 485.35698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=C(C=C5C(=C4)NC(=O)N5)Br

Isomeric SMILES

C1CC1C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=C(C=C5C(=C4)NC(=O)N5)Br

InChI

InChI=1S/C20H17BrN6O2S/c21-13-8-15-16(24-19(29)23-15)9-14(13)22-17(28)10-30-20-26-25-18(11-6-7-11)27(20)12-4-2-1-3-5-12/h1-5,8-9,11H,6-7,10H2,(H,22,28)(H2,23,24,29)