2-(2-chloranyl-6H-benzo[b][1,4]benzothiazepin-5-yl)-N,N-diethyl-ethanamine

Systemtic Name: 2-(2-chloranyl-6H-benzo[b][1,4]benzothiazepin-5-yl)-N,N-diethyl-ethanamine Openeye Name: 2-(2-chloro-6H-benzo[b][1,4]benzothiazepin-5-yl)-N,N-diethyl-ethanamine CAS Name: 2-(2-chloro-6H-benzo[b][1,4]benzothiazepin-5-yl)-N,N-diethylethanamine IUPAC Name: 2-(2-chloro-6H-benzo[b][1,4]benzothiazepin-5-yl)-N,N-diethylethanamine Traditional Name: 2-(2-chloro-6H-benzo[b][1,4]benzothiazepin-5-yl)ethyl-diethyl-amine Formula: C19H23ClN2S MolecularWeight: 346.91732

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1CC2=CC=CC=C2SC3=C1C=CC(=C3)Cl

Isomeric SMILES

CCN(CC)CCN1CC2=CC=CC=C2SC3=C1C=CC(=C3)Cl

InChI

InChI=1S/C19H23ClN2S/c1-3-21(4-2)11-12-22-14-15-7-5-6-8-18(15)23-19-13-16(20)9-10-17(19)22/h5-10,13H,3-4,11-12,14H2,1-2H3