(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-(3-ethoxy-4-methoxy-phenyl)methanone

Systemtic Name: (6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-(3-ethoxy-4-methoxy-phenyl)methanone Openeye Name: [6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-(3-ethoxy-4-methoxy-phenyl)methanone CAS Name: (6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-(3-ethoxy-4-methoxyphenyl)methanone IUPAC Name: (6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-(3-ethoxy-4-methoxyphenyl)methanone Traditional Name: [6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-(3-ethoxy-4-methoxy-phenyl)methanone Formula: C25H27NO5S MolecularWeight: 453.55058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCC3=CC(=C(C=C3C2C4=CC=CS4)OC)OC)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCC3=CC(=C(C=C3C2C4=CC=CS4)OC)OC)OC

InChI

InChI=1S/C25H27NO5S/c1-5-31-22-14-17(8-9-19(22)28-2)25(27)26-11-10-16-13-20(29-3)21(30-4)15-18(16)24(26)23-7-6-12-32-23/h6-9,12-15,24H,5,10-11H2,1-4H3