2-(1-butyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(1-butyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[1-butyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanyl-N-(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)acetamide CAS Name: 2-[[1-butyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]-N-[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(1-butyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanyl-N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(1-butyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]-N-(2-chloro-5-pyrrolidinosulfonyl-phenyl)acetamide Formula: C28H36ClN5O5S3 MolecularWeight: 654.26394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC(=O)NC4=C(C=CC(=C4)S(=O)(=O)N5CCCC5)Cl

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC(=O)NC4=C(C=CC(=C4)S(=O)(=O)N5CCCC5)Cl

InChI

InChI=1S/C28H36ClN5O5S3/c1-2-3-17-34-26-12-10-22(42(38,39)32-13-5-4-6-14-32)19-25(26)31-28(34)40-20-27(35)30-24-18-21(9-11-23(24)29)41(36,37)33-15-7-8-16-33/h9-12,18-19H,2-8,13-17,20H2,1H3,(H,30,35)