4-[5-bromanyl-6-(3-imidazol-1-ylpropylamino)pyridin-3-yl]sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide

Systemtic Name: 4-[5-bromanyl-6-(3-imidazol-1-ylpropylamino)pyridin-3-yl]sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide Openeye Name: 4-[[5-bromo-6-(3-imidazol-1-ylpropylamino)-3-pyridyl]sulfonyl]-5-methylsulfanyl-thiophene-2-carboxamidine CAS Name: 4-[[5-bromo-6-[3-(1-imidazolyl)propylamino]-3-pyridinyl]sulfonyl]-5-(methylthio)-2-thiophenecarboximidamide IUPAC Name: 4-[5-bromo-6-(3-imidazol-1-ylpropylamino)pyridin-3-yl]sulfonyl-5-methylsulfanylthiophene-2-carboximidamide Traditional Name: 4-[[5-bromo-6-(3-imidazol-1-ylpropylamino)-3-pyridyl]sulfonyl]-5-(methylthio)thiophene-2-carboxamidine Formula: C17H19BrN6O2S3 MolecularWeight: 515.47076

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(S1)C(=N)N)S(=O)(=O)C2=CC(=C(N=C2)NCCCN3C=CN=C3)Br

Isomeric SMILES

CSC1=C(C=C(S1)C(=N)N)S(=O)(=O)C2=CC(=C(N=C2)NCCCN3C=CN=C3)Br

InChI

InChI=1S/C17H19BrN6O2S3/c1-27-17-14(8-13(28-17)15(19)20)29(25,26)11-7-12(18)16(23-9-11)22-3-2-5-24-6-4-21-10-24/h4,6-10H,2-3,5H2,1H3,(H3,19,20)(H,22,23)