2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanyl-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamide

Systemtic Name: 2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanyl-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamide Openeye Name: 2-(5-chloro-1-propyl-benzimidazol-2-yl)sulfanyl-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide CAS Name: 2-[(5-chloro-1-propyl-2-benzimidazolyl)thio]-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide IUPAC Name: 2-(5-chloro-1-propylbenzimidazol-2-yl)sulfanyl-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide Traditional Name: 2-[(5-chloro-1-propyl-benzimidazol-2-yl)thio]-N-(2,4,5-trimethoxybenzyl)acetamide Formula: C22H26ClN3O4S MolecularWeight: 463.97754

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NCC3=CC(=C(C=C3OC)OC)OC

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NCC3=CC(=C(C=C3OC)OC)OC

InChI

InChI=1S/C22H26ClN3O4S/c1-5-8-26-17-7-6-15(23)10-16(17)25-22(26)31-13-21(27)24-12-14-9-19(29-3)20(30-4)11-18(14)28-2/h6-7,9-11H,5,8,12-13H2,1-4H3,(H,24,27)