6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-1,3-benzothiazol-2-one

Systemtic Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-1,3-benzothiazol-2-one Openeye Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-(2-oxo-2-pyrrolidin-1-yl-ethyl)-1,3-benzothiazol-2-one CAS Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1,3-benzothiazol-2-one IUPAC Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-benzothiazol-2-one Traditional Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-(2-keto-2-pyrrolidino-ethyl)-1,3-benzothiazol-2-one Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4)SC2=O

Isomeric SMILES

C1CCN(C1)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4)SC2=O

InChI

InChI=1S/C22H23N3O4S2/c26-21(23-10-3-4-11-23)15-25-19-8-7-18(13-20(19)30-22(25)27)31(28,29)24-12-9-16-5-1-2-6-17(16)14-24/h1-2,5-8,13H,3-4,9-12,14-15H2