2-(1H-benzimidazol-2-ylsulfanyl)-1-(5-morpholin-4-ylsulfonyl-2,3-dihydroindol-1-yl)ethanone

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(5-morpholin-4-ylsulfonyl-2,3-dihydroindol-1-yl)ethanone Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(5-morpholinosulfonylindolin-1-yl)ethanone CAS Name: 2-(1H-benzimidazol-2-ylthio)-1-[5-(4-morpholinylsulfonyl)-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(5-morpholin-4-ylsulfonyl-2,3-dihydroindol-1-yl)ethanone Traditional Name: 2-(1H-benzimidazol-2-ylthio)-1-(5-morpholinosulfonylindolin-1-yl)ethanone Formula: C21H22N4O4S2 MolecularWeight: 458.55378

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1CN(C2=C1C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C21H22N4O4S2/c26-20(14-30-21-22-17-3-1-2-4-18(17)23-21)25-8-7-15-13-16(5-6-19(15)25)31(27,28)24-9-11-29-12-10-24/h1-6,13H,7-12,14H2,(H,22,23)