4-[7-bromanyl-3-(3-methylbut-2-enyl)benzimidazol-5-yl]sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide

Systemtic Name: 4-[7-bromanyl-3-(3-methylbut-2-enyl)benzimidazol-5-yl]sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide Openeye Name: 4-[7-bromo-3-(3-methylbut-2-enyl)benzimidazol-5-yl]sulfonyl-5-methylsulfanyl-thiophene-2-carboxamidine CAS Name: 4-[[7-bromo-3-(3-methylbut-2-enyl)-5-benzimidazolyl]sulfonyl]-5-(methylthio)-2-thiophenecarboximidamide IUPAC Name: 4-[7-bromo-3-(3-methylbut-2-enyl)benzimidazol-5-yl]sulfonyl-5-methylsulfanylthiophene-2-carboximidamide Traditional Name: 4-[7-bromo-3-(3-methylbut-2-enyl)benzimidazol-5-yl]sulfonyl-5-(methylthio)thiophene-2-carboxamidine Formula: C18H19BrN4O2S3 MolecularWeight: 499.46806

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C=NC2=C(C=C(C=C21)S(=O)(=O)C3=C(SC(=C3)C(=N)N)SC)Br)C

Isomeric SMILES

CC(=CCN1C=NC2=C(C=C(C=C21)S(=O)(=O)C3=C(SC(=C3)C(=N)N)SC)Br)C

InChI

InChI=1S/C18H19BrN4O2S3/c1-10(2)4-5-23-9-22-16-12(19)6-11(7-13(16)23)28(24,25)15-8-14(17(20)21)27-18(15)26-3/h4,6-9H,5H2,1-3H3,(H3,20,21)