N-[[(1R)-2-(ethylcarbamothioyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxy-ethanamide

Systemtic Name: N-[[(1R)-2-(ethylcarbamothioyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxy-ethanamide Openeye Name: N-[[(1R)-2-(ethylcarbamothioyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxy-acetamide CAS Name: N-[[(1R)-2-[ethylamino(sulfanylidene)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxyacetamide IUPAC Name: N-[[(1R)-2-(ethylcarbamothioyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxyacetamide Traditional Name: N-[[(1R)-2-(ethylthiocarbamoyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxy-acetamide Formula: C18H27N3O4S MolecularWeight: 381.48968

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CCC2=CC(=C(C=C2C1CNC(=O)COC)OC)OC

Isomeric SMILES

CCNC(=S)N1CCC2=CC(=C(C=C2[C@@H]1CNC(=O)COC)OC)OC

InChI

InChI=1S/C18H27N3O4S/c1-5-19-18(26)21-7-6-12-8-15(24-3)16(25-4)9-13(12)14(21)10-20-17(22)11-23-2/h8-9,14H,5-7,10-11H2,1-4H3,(H,19,26)(H,20,22)/t14-/m0/s1