4-[2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanoyl]-3,3-dimethyl-1H-quinoxalin-2-one

Systemtic Name: 4-[2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[2-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxoethyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)acetyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[2-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CN3CCC4=CC(=C(C=C4C3C5=CC=CS5)OC)OC)C

Isomeric SMILES

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CN3CCC4=CC(=C(C=C4C3C5=CC=CS5)OC)OC)C

InChI

InChI=1S/C27H29N3O4S/c1-27(2)26(32)28-19-8-5-6-9-20(19)30(27)24(31)16-29-12-11-17-14-21(33-3)22(34-4)15-18(17)25(29)23-10-7-13-35-23/h5-10,13-15,25H,11-12,16H2,1-4H3,(H,28,32)