2-[(4-methylphenyl)methylsulfanyl]-1-propyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 1-propyl-2-(p-tolylmethylsulfanyl)benzimidazole-5-sulfonamide CAS Name: 2-[(4-methylphenyl)methylthio]-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-[(4-methylbenzyl)thio]-1-propyl-benzimidazole-5-sulfonamide Formula: C18H21N3O2S2 MolecularWeight: 375.50824

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CC=C(C=C3)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CC=C(C=C3)C

InChI

InChI=1S/C18H21N3O2S2/c1-3-10-21-17-9-8-15(25(19,22)23)11-16(17)20-18(21)24-12-14-6-4-13(2)5-7-14/h4-9,11H,3,10,12H2,1-2H3,(H2,19,22,23)