1-[5-[(4-chlorophenyl)methyl]-2,3-dihydro-1-benzothiepin-4-yl]-N,N-dimethyl-methanamine

Systemtic Name: 1-[5-[(4-chlorophenyl)methyl]-2,3-dihydro-1-benzothiepin-4-yl]-N,N-dimethyl-methanamine Openeye Name: 1-[5-[(4-chlorophenyl)methyl]-2,3-dihydro-1-benzothiepin-4-yl]-N,N-dimethyl-methanamine CAS Name: 1-[5-[(4-chlorophenyl)methyl]-2,3-dihydro-1-benzothiepin-4-yl]-N,N-dimethylmethanamine IUPAC Name: 1-[5-[(4-chlorophenyl)methyl]-2,3-dihydro-1-benzothiepin-4-yl]-N,N-dimethylmethanamine Traditional Name: [5-(4-chlorobenzyl)-2,3-dihydro-1-benzothiepin-4-yl]methyl-dimethyl-amine Formula: C20H22ClNS MolecularWeight: 343.91338

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(C2=CC=CC=C2SCC1)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C)CC1=C(C2=CC=CC=C2SCC1)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H22ClNS/c1-22(2)14-16-11-12-23-20-6-4-3-5-18(20)19(16)13-15-7-9-17(21)10-8-15/h3-10H,11-14H2,1-2H3