3-[2-(6-methoxy-2,3,3a,4,5,9b-hexahydro-1H-benzo[g]isoindol-1-yl)ethyl]-9-methyl-1H-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione

Systemtic Name: 3-[2-(6-methoxy-2,3,3a,4,5,9b-hexahydro-1H-benzo[g]isoindol-1-yl)ethyl]-9-methyl-1H-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione Openeye Name: 3-[2-(6-methoxy-2,3,3a,4,5,9b-hexahydro-1H-benzo[g]isoindol-1-yl)ethyl]-9-methyl-1H-benzothiopheno[3,2-d]pyrimidine-2,4-dione CAS Name: 3-[2-(6-methoxy-2,3,3a,4,5,9b-hexahydro-1H-benzo[g]isoindol-1-yl)ethyl]-9-methyl-1H-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione IUPAC Name: 3-[2-(6-methoxy-2,3,3a,4,5,9b-hexahydro-1H-benzo[g]isoindol-1-yl)ethyl]-9-methyl-1H-[1]benzothiolo[3,2-d]pyrimidine-2,4-dione Traditional Name: 3-[2-(6-methoxy-2,3,3a,4,5,9b-hexahydro-1H-benz[g]isoindol-1-yl)ethyl]-9-methyl-1H-benzothiopheno[3,2-d]pyrimidine-2,4-quinone Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC3=C2NC(=O)N(C3=O)CCC4C5C(CCC6=C5C=CC=C6OC)CN4

Isomeric SMILES

CC1=C2C(=CC=C1)SC3=C2NC(=O)N(C3=O)CCC4C5C(CCC6=C5C=CC=C6OC)CN4

InChI

InChI=1S/C26H27N3O3S/c1-14-5-3-8-20-21(14)23-24(33-20)25(30)29(26(31)28-23)12-11-18-22-15(13-27-18)9-10-16-17(22)6-4-7-19(16)32-2/h3-8,15,18,22,27H,9-13H2,1-2H3,(H,28,31)