1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4,6-dimethyl-2-sulfanylidene-pyridine-3-carboxamide

Systemtic Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4,6-dimethyl-2-sulfanylidene-pyridine-3-carboxamide Openeye Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4,6-dimethyl-2-thioxo-pyridine-3-carboxamide CAS Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4,6-dimethyl-2-sulfanylidene-3-pyridinecarboxamide IUPAC Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4,6-dimethyl-2-sulfanylidenepyridine-3-carboxamide Traditional Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4,6-dimethyl-2-thioxo-nicotinamide Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=S)N1CN2CCC3=CC(=C(C=C3C2)OC)OC)C(=O)N)C

Isomeric SMILES

CC1=CC(=C(C(=S)N1CN2CCC3=CC(=C(C=C3C2)OC)OC)C(=O)N)C

InChI

InChI=1S/C20H25N3O3S/c1-12-7-13(2)23(20(27)18(12)19(21)24)11-22-6-5-14-8-16(25-3)17(26-4)9-15(14)10-22/h7-9H,5-6,10-11H2,1-4H3,(H2,21,24)