4-(7-bromanyl-1-prop-2-enyl-benzimidazol-5-yl)sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide

Systemtic Name: 4-(7-bromanyl-1-prop-2-enyl-benzimidazol-5-yl)sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide Openeye Name: 4-(1-allyl-7-bromo-benzimidazol-5-yl)sulfonyl-5-methylsulfanyl-thiophene-2-carboxamidine CAS Name: 4-[(7-bromo-1-prop-2-enyl-5-benzimidazolyl)sulfonyl]-5-(methylthio)-2-thiophenecarboximidamide IUPAC Name: 4-(7-bromo-1-prop-2-enylbenzimidazol-5-yl)sulfonyl-5-methylsulfanylthiophene-2-carboximidamide Traditional Name: 4-(1-allyl-7-bromo-benzimidazol-5-yl)sulfonyl-5-(methylthio)thiophene-2-carboxamidine Formula: C16H15BrN4O2S3 MolecularWeight: 471.4149

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(S1)C(=N)N)S(=O)(=O)C2=CC(=C3C(=C2)N=CN3CC=C)Br

Isomeric SMILES

CSC1=C(C=C(S1)C(=N)N)S(=O)(=O)C2=CC(=C3C(=C2)N=CN3CC=C)Br

InChI

InChI=1S/C16H15BrN4O2S3/c1-3-4-21-8-20-11-6-9(5-10(17)14(11)21)26(22,23)13-7-12(15(18)19)25-16(13)24-2/h3,5-8H,1,4H2,2H3,(H3,18,19)