2-(3-ethylsulfanyl-11-methyl-benzo[b][1]benzazepin-5-yl)-N,N-dimethyl-ethanamine

Systemtic Name: 2-(3-ethylsulfanyl-11-methyl-benzo[b][1]benzazepin-5-yl)-N,N-dimethyl-ethanamine Openeye Name: 2-(3-ethylsulfanyl-11-methyl-benzo[b][1]benzazepin-5-yl)-N,N-dimethyl-ethanamine CAS Name: 2-[3-(ethylthio)-11-methyl-5-benzo[b][1]benzazepinyl]-N,N-dimethylethanamine IUPAC Name: 2-(3-ethylsulfanyl-11-methylbenzo[b][1]benzazepin-5-yl)-N,N-dimethylethanamine Traditional Name: 2-[3-(ethylthio)-11-methyl-benzo[b][1]benzazepin-5-yl]ethyl-dimethyl-amine Formula: C21H26N2S MolecularWeight: 338.50954

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC2=C(C=C1)N(C3=CC=CC=C3C=C2CCN(C)C)C

Isomeric SMILES

CCSC1=CC2=C(C=C1)N(C3=CC=CC=C3C=C2CCN(C)C)C

InChI

InChI=1S/C21H26N2S/c1-5-24-18-10-11-21-19(15-18)16(12-13-22(2)3)14-17-8-6-7-9-20(17)23(21)4/h6-11,14-15H,5,12-13H2,1-4H3