N-butyl-2-[(3-methoxyphenyl)methylsulfanyl]-3H-benzimidazole-5-sulfonamide

Systemtic Name: N-butyl-2-[(3-methoxyphenyl)methylsulfanyl]-3H-benzimidazole-5-sulfonamide Openeye Name: N-butyl-2-[(3-methoxyphenyl)methylsulfanyl]-3H-benzimidazole-5-sulfonamide CAS Name: N-butyl-2-[(3-methoxyphenyl)methylthio]-3H-benzimidazole-5-sulfonamide IUPAC Name: N-butyl-2-[(3-methoxyphenyl)methylsulfanyl]-3H-benzimidazole-5-sulfonamide Traditional Name: N-butyl-2-(m-anisylthio)-3H-benzimidazole-5-sulfonamide Formula: C19H23N3O3S2 MolecularWeight: 405.53422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)SCC3=CC(=CC=C3)OC

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)SCC3=CC(=CC=C3)OC

InChI

InChI=1S/C19H23N3O3S2/c1-3-4-10-20-27(23,24)16-8-9-17-18(12-16)22-19(21-17)26-13-14-6-5-7-15(11-14)25-2/h5-9,11-12,20H,3-4,10,13H2,1-2H3,(H,21,22)