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

Systemtic Name: 2-[(4-methoxyphenyl)methylsulfanyl]-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(4-methoxyphenyl)methylsulfanyl]-1-propyl-benzimidazole-5-sulfonamide CAS Name: 2-[(4-methoxyphenyl)methylthio]-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(4-methoxyphenyl)methylsulfanyl]-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-(p-anisylthio)-1-propyl-benzimidazole-5-sulfonamide Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O3S2/c1-3-10-21-17-9-8-15(26(19,22)23)11-16(17)20-18(21)25-12-13-4-6-14(24-2)7-5-13/h4-9,11H,3,10,12H2,1-2H3,(H2,19,22,23)