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

Systemtic Name: (6-chloranylpyridin-3-yl)-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]methanone Openeye Name: (6-chloro-3-pyridyl)-[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone CAS Name: (6-chloro-3-pyridinyl)-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]methanone IUPAC Name: (6-chloropyridin-3-yl)-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]methanone Traditional Name: (6-chloro-3-pyridyl)-[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone Formula: C21H19ClN2O3S MolecularWeight: 414.90516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CN=C(C=C3)Cl)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)C(=O)C3=CN=C(C=C3)Cl)C4=CC=CS4)OC

InChI

InChI=1S/C21H19ClN2O3S/c1-26-16-10-13-7-8-24(21(25)14-5-6-19(22)23-12-14)20(18-4-3-9-28-18)15(13)11-17(16)27-2/h3-6,9-12,20H,7-8H2,1-2H3/t20-/m0/s1