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

Systemtic Name: 7,8-dimethoxy-3-[[1-(4-thiophen-2-ylbutyl)piperidin-3-yl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 7,8-dimethoxy-3-[[1-[4-(2-thienyl)butyl]-3-piperidyl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 7,8-dimethoxy-3-[[1-(4-thiophen-2-ylbutyl)-3-piperidinyl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 7,8-dimethoxy-3-[[1-(4-thiophen-2-ylbutyl)piperidin-3-yl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 7,8-dimethoxy-3-[[1-[4-(2-thienyl)butyl]-3-piperidyl]methyl]-2,5-dihydro-1H-3-benzazepin-4-one Formula: C26H36N2O3S MolecularWeight: 456.64064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CC(=O)N(CCC2=C1)CC3CCCN(C3)CCCCC4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2CC(=O)N(CCC2=C1)CC3CCCN(C3)CCCCC4=CC=CS4)OC

InChI

InChI=1S/C26H36N2O3S/c1-30-24-15-21-10-13-28(26(29)17-22(21)16-25(24)31-2)19-20-7-5-12-27(18-20)11-4-3-8-23-9-6-14-32-23/h6,9,14-16,20H,3-5,7-8,10-13,17-19H2,1-2H3