3-[[1-[2-(5-methoxy-1-benzothiophen-3-yl)ethyl]piperidin-3-yl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one

Systemtic Name: 3-[[1-[2-(5-methoxy-1-benzothiophen-3-yl)ethyl]piperidin-3-yl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 3-[[1-[2-(5-methoxybenzothiophen-3-yl)ethyl]-3-piperidyl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 3-[[1-[2-(5-methoxy-1-benzothiophen-3-yl)ethyl]-3-piperidinyl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 3-[[1-[2-(5-methoxy-1-benzothiophen-3-yl)ethyl]piperidin-3-yl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 3-[[1-[2-(5-methoxybenzothiophen-3-yl)ethyl]-3-piperidyl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one Formula: C29H36N2O2S MolecularWeight: 476.67334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2CC(=O)N(CCC2=C1)CC3CCCN(C3)CCC4=CSC5=C4C=C(C=C5)OC)C

Isomeric SMILES

CC1=C(C=C2CC(=O)N(CCC2=C1)CC3CCCN(C3)CCC4=CSC5=C4C=C(C=C5)OC)C

InChI

InChI=1S/C29H36N2O2S/c1-20-13-23-9-12-31(29(32)15-25(23)14-21(20)2)18-22-5-4-10-30(17-22)11-8-24-19-34-28-7-6-26(33-3)16-27(24)28/h6-7,13-14,16,19,22H,4-5,8-12,15,17-18H2,1-3H3