3,4-dihydro-1H-isoquinolin-2-yl-[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(thiazol-4-ylmethylsulfanyl)phenyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(4-thiazolylmethylthio)phenyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(thiazol-4-ylmethylthio)phenyl]methanone Formula: C20H18N2OS2 MolecularWeight: 366.49972

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=CC=C3SCC4=CSC=N4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=CC=C3SCC4=CSC=N4

InChI

InChI=1S/C20H18N2OS2/c23-20(22-10-9-15-5-1-2-6-16(15)11-22)18-7-3-4-8-19(18)25-13-17-12-24-14-21-17/h1-8,12,14H,9-11,13H2