2-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-N-phenyl-ethanethioamide

Systemtic Name: 2-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-N-phenyl-ethanethioamide Openeye Name: 2-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-N-phenyl-thioacetamide CAS Name: 2-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-N-phenylethanethioamide IUPAC Name: 2-(7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-N-phenylethanethioamide Traditional Name: 2-(7,8-dihydro-[1,3]dioxol[4,5-g]isoquinolin-5-yl)-N-phenyl-thioacetamide Formula: C18H16N2O2S MolecularWeight: 324.39684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=CC3=C(C=C21)OCO3)CC(=S)NC4=CC=CC=C4

Isomeric SMILES

C1CN=C(C2=CC3=C(C=C21)OCO3)CC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C18H16N2O2S/c23-18(20-13-4-2-1-3-5-13)10-15-14-9-17-16(21-11-22-17)8-12(14)6-7-19-15/h1-5,8-9H,6-7,10-11H2,(H,20,23)