2-(3,3-dimethyl-4H-isoquinolin-1-yl)-N-phenyl-ethanethioamide

Systemtic Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-N-phenyl-ethanethioamide Openeye Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-N-phenyl-thioacetamide CAS Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-N-phenylethanethioamide IUPAC Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-N-phenylethanethioamide Traditional Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-N-phenyl-thioacetamide Formula: C19H20N2S MolecularWeight: 308.4405

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=N1)CC(=S)NC3=CC=CC=C3)C

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=N1)CC(=S)NC3=CC=CC=C3)C

InChI

InChI=1S/C19H20N2S/c1-19(2)13-14-8-6-7-11-16(14)17(21-19)12-18(22)20-15-9-4-3-5-10-15/h3-11H,12-13H2,1-2H3,(H,20,22)