3-chloranyl-N-phenethyl-5,6-dihydrobenzo[b][1]benzothiepin-6-amine

Systemtic Name: 3-chloranyl-N-phenethyl-5,6-dihydrobenzo[b][1]benzothiepin-6-amine Openeye Name: 3-chloro-N-phenethyl-5,6-dihydrobenzo[b][1]benzothiepin-6-amine CAS Name: 3-chloro-N-phenethyl-5,6-dihydrobenzo[b][1]benzothiepin-6-amine IUPAC Name: 3-chloro-N-phenethyl-5,6-dihydrobenzo[b][1]benzothiepin-6-amine Traditional Name: (3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-phenethyl-amine Formula: C22H20ClNS MolecularWeight: 365.9189

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2SC3=C1C=C(C=C3)Cl)NCCC4=CC=CC=C4

Isomeric SMILES

C1C(C2=CC=CC=C2SC3=C1C=C(C=C3)Cl)NCCC4=CC=CC=C4

InChI

InChI=1S/C22H20ClNS/c23-18-10-11-21-17(14-18)15-20(19-8-4-5-9-22(19)25-21)24-13-12-16-6-2-1-3-7-16/h1-11,14,20,24H,12-13,15H2