6-chloranyl-2-[[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-1H-quinazolin-4-one Openeye Name: 6-chloro-2-[[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-1H-quinazolin-4-one CAS Name: 6-chloro-2-[[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-1H-quinazolin-4-one IUPAC Name: 6-chloro-2-[[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-1H-quinazolin-4-one Traditional Name: 6-chloro-2-[[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-1H-quinazolin-4-one Formula: C24H22ClN3O3S MolecularWeight: 467.96778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC3=NC(=O)C4=C(N3)C=CC(=C4)Cl)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)CC3=NC(=O)C4=C(N3)C=CC(=C4)Cl)C5=CC=CS5)OC

InChI

InChI=1S/C24H22ClN3O3S/c1-30-19-10-14-7-8-28(23(21-4-3-9-32-21)16(14)12-20(19)31-2)13-22-26-18-6-5-15(25)11-17(18)24(29)27-22/h3-6,9-12,23H,7-8,13H2,1-2H3,(H,26,27,29)/t23-/m0/s1