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

Systemtic Name: 3-[[1-[5-(1-benzothiophen-3-yl)pentyl]piperidin-3-yl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 3-[[1-[5-(benzothiophen-3-yl)pentyl]-3-piperidyl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 3-[[1-[5-(1-benzothiophen-3-yl)pentyl]-3-piperidinyl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 3-[[1-[5-(1-benzothiophen-3-yl)pentyl]piperidin-3-yl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 3-[[1-[5-(benzothiophen-3-yl)pentyl]-3-piperidyl]methyl]-7,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one Formula: C31H40N2OS MolecularWeight: 488.7271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2CC(=O)N(CCC2=C1)CC3CCCN(C3)CCCCCC4=CSC5=CC=CC=C54)C

Isomeric SMILES

CC1=C(C=C2CC(=O)N(CCC2=C1)CC3CCCN(C3)CCCCCC4=CSC5=CC=CC=C54)C

InChI

InChI=1S/C31H40N2OS/c1-23-17-26-13-16-33(31(34)19-28(26)18-24(23)2)21-25-9-8-15-32(20-25)14-7-3-4-10-27-22-35-30-12-6-5-11-29(27)30/h5-6,11-12,17-18,22,25H,3-4,7-10,13-16,19-21H2,1-2H3