3-[3-[2-(1-benzothiophen-3-yl)ethyl-methyl-amino]propyl]-7,8-dimethoxy-1,2-dihydro-3-benzazepine-4,5-dione

Systemtic Name: 3-[3-[2-(1-benzothiophen-3-yl)ethyl-methyl-amino]propyl]-7,8-dimethoxy-1,2-dihydro-3-benzazepine-4,5-dione Openeye Name: 3-[3-[2-(benzothiophen-3-yl)ethyl-methyl-amino]propyl]-7,8-dimethoxy-1,2-dihydro-3-benzazepine-4,5-dione CAS Name: 3-[3-[2-(1-benzothiophen-3-yl)ethyl-methylamino]propyl]-7,8-dimethoxy-1,2-dihydro-3-benzazepine-4,5-dione IUPAC Name: 3-[3-[2-(1-benzothiophen-3-yl)ethyl-methylamino]propyl]-7,8-dimethoxy-1,2-dihydro-3-benzazepine-4,5-dione Traditional Name: 3-[3-[2-(benzothiophen-3-yl)ethyl-methyl-amino]propyl]-7,8-dimethoxy-1,2-dihydro-3-benzazepine-4,5-quinone Formula: C26H30N2O4S MolecularWeight: 466.5924

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1CCC2=CC(=C(C=C2C(=O)C1=O)OC)OC)CCC3=CSC4=CC=CC=C43

Isomeric SMILES

CN(CCCN1CCC2=CC(=C(C=C2C(=O)C1=O)OC)OC)CCC3=CSC4=CC=CC=C43

InChI

InChI=1S/C26H30N2O4S/c1-27(13-9-19-17-33-24-8-5-4-7-20(19)24)11-6-12-28-14-10-18-15-22(31-2)23(32-3)16-21(18)25(29)26(28)30/h4-5,7-8,15-17H,6,9-14H2,1-3H3