4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]-1,2-benzothiazol-3-one

Systemtic Name: 4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]-1,2-benzothiazol-3-one Openeye Name: 4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]-1,2-benzothiazol-3-one CAS Name: 4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]-1,2-benzothiazol-3-one IUPAC Name: 4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]-1,2-benzothiazol-3-one Traditional Name: 4-[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]-1,2-benzothiazol-3-one Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C2=CC=CC=C21)CCC3=C4C(=CC=C3)SNC4=O

Isomeric SMILES

C1CNC(C2=CC=CC=C21)CCC3=C4C(=CC=C3)SNC4=O

InChI

InChI=1S/C18H18N2OS/c21-18-17-13(5-3-7-16(17)22-20-18)8-9-15-14-6-2-1-4-12(14)10-11-19-15/h1-7,15,19H,8-11H2,(H,20,21)