4-[2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-2-methyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-2-methyl-1,4-benzoxazin-3-one Openeye Name: 4-[2-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxo-ethyl]-2-methyl-1,4-benzoxazin-3-one CAS Name: 4-[2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-methyl-1,4-benzoxazin-3-one IUPAC Name: 4-[2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-methyl-1,4-benzoxazin-3-one Traditional Name: 4-[2-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-keto-ethyl]-2-methyl-1,4-benzoxazin-3-one Formula: C26H26N2O5S MolecularWeight: 478.56004

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CC(=O)N3CCC4=CC(=C(C=C4C3C5=CC=CS5)OC)OC

Isomeric SMILES

CC1C(=O)N(C2=CC=CC=C2O1)CC(=O)N3CCC4=CC(=C(C=C4C3C5=CC=CS5)OC)OC

InChI

InChI=1S/C26H26N2O5S/c1-16-26(30)28(19-7-4-5-8-20(19)33-16)15-24(29)27-11-10-17-13-21(31-2)22(32-3)14-18(17)25(27)23-9-6-12-34-23/h4-9,12-14,16,25H,10-11,15H2,1-3H3