(3S)-1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-N-ethyl-N-methyl-pyrrolidin-3-amine

Systemtic Name: (3S)-1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-N-ethyl-N-methyl-pyrrolidin-3-amine Openeye Name: (3S)-1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-N-ethyl-N-methyl-pyrrolidin-3-amine CAS Name: (3S)-1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-N-ethyl-N-methyl-3-pyrrolidinamine IUPAC Name: (3S)-1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-N-ethyl-N-methylpyrrolidin-3-amine Traditional Name: [(3S)-1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)pyrrolidin-3-yl]-ethyl-methyl-amine Formula: C21H26N2S MolecularWeight: 338.50954

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C1CCN(C1)C2CC3=CC=CC=C3SC4=CC=CC=C24

Isomeric SMILES

CCN(C)[C@H]1CCN(C1)C2CC3=CC=CC=C3SC4=CC=CC=C24

InChI

InChI=1S/C21H26N2S/c1-3-22(2)17-12-13-23(15-17)19-14-16-8-4-6-10-20(16)24-21-11-7-5-9-18(19)21/h4-11,17,19H,3,12-15H2,1-2H3/t17-,19?/m0/s1