7,8-dimethoxy-3-[3-[2-(6-methoxy-1-benzothiophen-3-yl)ethyl-methyl-amino]propyl]-1H-3-benzazepin-2-one

Systemtic Name: 7,8-dimethoxy-3-[3-[2-(6-methoxy-1-benzothiophen-3-yl)ethyl-methyl-amino]propyl]-1H-3-benzazepin-2-one Openeye Name: 7,8-dimethoxy-3-[3-[2-(6-methoxybenzothiophen-3-yl)ethyl-methyl-amino]propyl]-1H-3-benzazepin-2-one CAS Name: 7,8-dimethoxy-3-[3-[2-(6-methoxy-1-benzothiophen-3-yl)ethyl-methylamino]propyl]-1H-3-benzazepin-2-one IUPAC Name: 7,8-dimethoxy-3-[3-[2-(6-methoxy-1-benzothiophen-3-yl)ethyl-methylamino]propyl]-1H-3-benzazepin-2-one Traditional Name: 7,8-dimethoxy-3-[3-[2-(6-methoxybenzothiophen-3-yl)ethyl-methyl-amino]propyl]-1H-3-benzazepin-2-one Formula: C27H32N2O4S MolecularWeight: 480.61898

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1C=CC2=CC(=C(C=C2CC1=O)OC)OC)CCC3=CSC4=C3C=CC(=C4)OC

Isomeric SMILES

CN(CCCN1C=CC2=CC(=C(C=C2CC1=O)OC)OC)CCC3=CSC4=C3C=CC(=C4)OC

InChI

InChI=1S/C27H32N2O4S/c1-28(12-8-20-18-34-26-17-22(31-2)6-7-23(20)26)10-5-11-29-13-9-19-14-24(32-3)25(33-4)15-21(19)16-27(29)30/h6-7,9,13-15,17-18H,5,8,10-12,16H2,1-4H3