2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-propyl]-1,1-diketo-1,2-benzothiazol-3-one Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CCN3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CCN3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C19H18N2O4S/c22-18(20-11-9-14-5-1-2-6-15(14)13-20)10-12-21-19(23)16-7-3-4-8-17(16)26(21,24)25/h1-8H,9-13H2