2-(1-hexylbenzimidazol-2-yl)sulfanyl-N-(4-methylsulfonylphenyl)ethanamide

Systemtic Name: 2-(1-hexylbenzimidazol-2-yl)sulfanyl-N-(4-methylsulfonylphenyl)ethanamide Openeye Name: 2-(1-hexylbenzimidazol-2-yl)sulfanyl-N-(4-methylsulfonylphenyl)acetamide CAS Name: 2-[(1-hexyl-2-benzimidazolyl)thio]-N-(4-methylsulfonylphenyl)acetamide IUPAC Name: 2-(1-hexylbenzimidazol-2-yl)sulfanyl-N-(4-methylsulfonylphenyl)acetamide Traditional Name: 2-[(1-hexylbenzimidazol-2-yl)thio]-N-(4-mesylphenyl)acetamide Formula: C22H27N3O3S2 MolecularWeight: 445.59808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H27N3O3S2/c1-3-4-5-8-15-25-20-10-7-6-9-19(20)24-22(25)29-16-21(26)23-17-11-13-18(14-12-17)30(2,27)28/h6-7,9-14H,3-5,8,15-16H2,1-2H3,(H,23,26)