6,7-dimethoxy-1-[(4-methyl-2-oxidanylidene-chromen-7-yl)oxymethyl]-N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: 6,7-dimethoxy-1-[(4-methyl-2-oxidanylidene-chromen-7-yl)oxymethyl]-N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: 6,7-dimethoxy-1-[(4-methyl-2-oxo-chromen-7-yl)oxymethyl]-N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: 6,7-dimethoxy-1-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxymethyl]-N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: 6,7-dimethoxy-1-[(4-methyl-2-oxochromen-7-yl)oxymethyl]-N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: 1-[(2-keto-4-methyl-chromen-7-yl)oxymethyl]-6,7-dimethoxy-N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C29H28N2O5S MolecularWeight: 516.60802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3C4=CC(=C(C=C4CCN3C(=S)NC5=CC=CC=C5)OC)OC

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3C4=CC(=C(C=C4CCN3C(=S)NC5=CC=CC=C5)OC)OC

InChI

InChI=1S/C29H28N2O5S/c1-18-13-28(32)36-25-15-21(9-10-22(18)25)35-17-24-23-16-27(34-3)26(33-2)14-19(23)11-12-31(24)29(37)30-20-7-5-4-6-8-20/h4-10,13-16,24H,11-12,17H2,1-3H3,(H,30,37)