6,7-diethoxy-N-ethyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: 6,7-diethoxy-N-ethyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: 6,7-diethoxy-N-ethyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: 6,7-diethoxy-N-ethyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: 6,7-diethoxy-N-ethyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: 6,7-diethoxy-N-ethyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CCC2=CC(=C(C=C2C1)OCC)OCC

Isomeric SMILES

CCNC(=S)N1CCC2=CC(=C(C=C2C1)OCC)OCC

InChI

InChI=1S/C16H24N2O2S/c1-4-17-16(21)18-8-7-12-9-14(19-5-2)15(20-6-3)10-13(12)11-18/h9-10H,4-8,11H2,1-3H3,(H,17,21)