1-butyl-2-(pyrimidin-2-ylsulfanylmethyl)benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-(pyrimidin-2-ylsulfanylmethyl)benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-(pyrimidin-2-ylsulfanylmethyl)benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[(2-pyrimidinylthio)methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-(pyrimidin-2-ylsulfanylmethyl)benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[(2-pyrimidylthio)methyl]benzimidazole-5-sulfonamide Formula: C16H19N5O2S2 MolecularWeight: 377.48436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSC3=NC=CC=N3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSC3=NC=CC=N3

InChI

InChI=1S/C16H19N5O2S2/c1-2-3-9-21-14-6-5-12(25(17,22)23)10-13(14)20-15(21)11-24-16-18-7-4-8-19-16/h4-8,10H,2-3,9,11H2,1H3,(H2,17,22,23)