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

Systemtic Name: 7,8-dimethyl-3-[[1-(5-thiophen-2-ylpentyl)piperidin-3-yl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 7,8-dimethyl-3-[[1-[5-(2-thienyl)pentyl]-3-piperidyl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 7,8-dimethyl-3-[[1-(5-thiophen-2-ylpentyl)-3-piperidinyl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 7,8-dimethyl-3-[[1-(5-thiophen-2-ylpentyl)piperidin-3-yl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 7,8-dimethyl-3-[[1-[5-(2-thienyl)pentyl]-3-piperidyl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one Formula: C27H38N2OS MolecularWeight: 438.66842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2CC(=O)N(CCC2=C1)CC3CCCN(C3)CCCCCC4=CC=CS4)C

Isomeric SMILES

CC1=C(C=C2CC(=O)N(CCC2=C1)CC3CCCN(C3)CCCCCC4=CC=CS4)C

InChI

InChI=1S/C27H38N2OS/c1-21-16-24-11-14-29(27(30)18-25(24)17-22(21)2)20-23-8-6-13-28(19-23)12-5-3-4-9-26-10-7-15-31-26/h7,10,15-17,23H,3-6,8-9,11-14,18-20H2,1-2H3