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

Systemtic Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-6-morpholin-4-ylsulfonyl-1,3-benzothiazol-2-one Openeye Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-6-morpholinosulfonyl-1,3-benzothiazol-2-one CAS Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-6-(4-morpholinylsulfonyl)-1,3-benzothiazol-2-one IUPAC Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-6-morpholin-4-ylsulfonyl-1,3-benzothiazol-2-one Traditional Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-6-morpholinosulfonyl-1,3-benzothiazol-2-one Formula: C22H23N3O5S2 MolecularWeight: 473.56512

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CN3C4=C(C=C(C=C4)S(=O)(=O)N5CCOCC5)SC3=O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CN3C4=C(C=C(C=C4)S(=O)(=O)N5CCOCC5)SC3=O

InChI

InChI=1S/C22H23N3O5S2/c26-21(23-8-7-16-3-1-2-4-17(16)14-23)15-25-19-6-5-18(13-20(19)31-22(25)27)32(28,29)24-9-11-30-12-10-24/h1-6,13H,7-12,14-15H2