[2-[(6-bromanyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]-2-oxidanylidene-ethyl]-methyl-[(3-methylthiophen-2-yl)methyl]azanium

Systemtic Name: [2-[(6-bromanyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]-2-oxidanylidene-ethyl]-methyl-[(3-methylthiophen-2-yl)methyl]azanium Openeye Name: [2-[(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]-2-oxo-ethyl]-methyl-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: [2-[(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]-2-oxoethyl]-methyl-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: [2-[(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]-2-oxoethyl]-methyl-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: [2-[(6-bromo-2-keto-1,3-dihydrobenzimidazol-5-yl)amino]-2-keto-ethyl]-methyl-[(3-methyl-2-thienyl)methyl]ammonium Formula: C16H18BrN4O2S+ MolecularWeight: 410.30872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+](C)CC(=O)NC2=C(C=C3C(=C2)NC(=O)N3)Br

Isomeric SMILES

CC1=C(SC=C1)C[NH+](C)CC(=O)NC2=C(C=C3C(=C2)NC(=O)N3)Br

InChI

InChI=1S/C16H17BrN4O2S/c1-9-3-4-24-14(9)7-21(2)8-15(22)18-11-6-13-12(5-10(11)17)19-16(23)20-13/h3-6H,7-8H2,1-2H3,(H,18,22)(H2,19,20,23)/p+1