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

Systemtic Name: 2-[3-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxidanylidene-propyl]-1H-quinazolin-4-one Openeye Name: 2-[3-[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxo-propyl]-1H-quinazolin-4-one CAS Name: 2-[3-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxopropyl]-1H-quinazolin-4-one IUPAC Name: 2-[3-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxopropyl]-1H-quinazolin-4-one Traditional Name: 2-[3-[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-keto-propyl]-1H-quinazolin-4-one Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CCC3=NC(=O)C4=CC=CC=C4N3)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)C(=O)CCC3=NC(=O)C4=CC=CC=C4N3)C5=CC=CS5)OC

InChI

InChI=1S/C26H25N3O4S/c1-32-20-14-16-11-12-29(25(22-8-5-13-34-22)18(16)15-21(20)33-2)24(30)10-9-23-27-19-7-4-3-6-17(19)26(31)28-23/h3-8,13-15,25H,9-12H2,1-2H3,(H,27,28,31)/t25-/m0/s1