2-[(2R)-3-(2-methyl-1-oxidanylidene-3,4-dihydropyrido[3,4-b]indol-9-yl)-2-oxidanyl-propyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[(2R)-3-(2-methyl-1-oxidanylidene-3,4-dihydropyrido[3,4-b]indol-9-yl)-2-oxidanyl-propyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[(2R)-2-hydroxy-3-(2-methyl-1-oxo-3,4-dihydropyrido[3,4-b]indol-9-yl)propyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[(2R)-2-hydroxy-3-(2-methyl-1-oxo-3,4-dihydropyrido[3,4-b]indol-9-yl)propyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[(2R)-2-hydroxy-3-(2-methyl-1-oxo-3,4-dihydropyrido[3,4-b]indol-9-yl)propyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 2-[(2R)-2-hydroxy-3-(1-keto-2-methyl-3,4-dihydro-$b-carbolin-9-yl)propyl]-1,1-diketo-1,2-benzothiazol-3-one Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1=O)N(C3=CC=CC=C23)CC(CN4C(=O)C5=CC=CC=C5S4(=O)=O)O

Isomeric SMILES

CN1CCC2=C(C1=O)N(C3=CC=CC=C23)C[C@H](CN4C(=O)C5=CC=CC=C5S4(=O)=O)O

InChI

InChI=1S/C22H21N3O5S/c1-23-11-10-16-15-6-2-4-8-18(15)24(20(16)22(23)28)12-14(26)13-25-21(27)17-7-3-5-9-19(17)31(25,29)30/h2-9,14,26H,10-13H2,1H3/t14-/m1/s1