(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone

Systemtic Name: (6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone Openeye Name: (6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[3-(1-piperidylsulfonyl)-2-thienyl]methanone CAS Name: (6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[3-(1-piperidinylsulfonyl)-2-thiophenyl]methanone IUPAC Name: (6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone Traditional Name: (6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-piperidinosulfonyl-2-thienyl)methanone Formula: C23H30N2O5S2 MolecularWeight: 478.6247

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4)OCC

InChI

InChI=1S/C23H30N2O5S2/c1-3-29-19-14-17-8-12-24(16-18(17)15-20(19)30-4-2)23(26)22-21(9-13-31-22)32(27,28)25-10-6-5-7-11-25/h9,13-15H,3-8,10-12,16H2,1-2H3