(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(3S)-1-thiophen-2-ylcarbonylpiperidin-3-yl]methanone

Systemtic Name: (6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(3S)-1-thiophen-2-ylcarbonylpiperidin-3-yl]methanone Openeye Name: (6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(3S)-1-(thiophene-2-carbonyl)-3-piperidyl]methanone CAS Name: (6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(3S)-1-[oxo(thiophen-2-yl)methyl]-3-piperidinyl]methanone IUPAC Name: (6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(3S)-1-(thiophene-2-carbonyl)piperidin-3-yl]methanone Traditional Name: (6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(3S)-1-(2-thenoyl)-3-piperidyl]methanone Formula: C24H30N2O4S MolecularWeight: 442.571

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3CCCN(C3)C(=O)C4=CC=CS4)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)[C@H]3CCCN(C3)C(=O)C4=CC=CS4)OCC

InChI

InChI=1S/C24H30N2O4S/c1-3-29-20-13-17-9-11-26(16-19(17)14-21(20)30-4-2)23(27)18-7-5-10-25(15-18)24(28)22-8-6-12-31-22/h6,8,12-14,18H,3-5,7,9-11,15-16H2,1-2H3/t18-/m0/s1