3-[3-[2-(1-benzothiophen-3-yl)propyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one

Systemtic Name: 3-[3-[2-(1-benzothiophen-3-yl)propyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 3-[3-[2-(benzothiophen-3-yl)propyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 3-[3-[2-(1-benzothiophen-3-yl)propyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 3-[3-[2-(1-benzothiophen-3-yl)propyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 3-[3-[2-(benzothiophen-3-yl)propyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Formula: C27H34N2O3S MolecularWeight: 466.63546

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C)CCCN1CCC2=CC(=C(C=C2CC1=O)OC)OC)C3=CSC4=CC=CC=C43

Isomeric SMILES

CC(CN(C)CCCN1CCC2=CC(=C(C=C2CC1=O)OC)OC)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C27H34N2O3S/c1-19(23-18-33-26-9-6-5-8-22(23)26)17-28(2)11-7-12-29-13-10-20-14-24(31-3)25(32-4)15-21(20)16-27(29)30/h5-6,8-9,14-15,18-19H,7,10-13,16-17H2,1-4H3