2-(1H-benzimidazol-2-ylsulfanyl)-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[6-(1-pyrrolidinylsulfonyl)-1,3-benzothiazol-2-yl]acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-(6-pyrrolidinosulfonyl-1,3-benzothiazol-2-yl)acetamide Formula: C20H19N5O3S3 MolecularWeight: 473.59156

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C20H19N5O3S3/c26-18(12-29-19-21-14-5-1-2-6-15(14)22-19)24-20-23-16-8-7-13(11-17(16)30-20)31(27,28)25-9-3-4-10-25/h1-2,5-8,11H,3-4,9-10,12H2,(H,21,22)(H,23,24,26)