5-[(4-chlorophenyl)methyl]-4-(dimethylaminomethyl)-3,4-dihydro-2H-1-benzothiepin-5-ol

Systemtic Name: 5-[(4-chlorophenyl)methyl]-4-(dimethylaminomethyl)-3,4-dihydro-2H-1-benzothiepin-5-ol Openeye Name: 5-[(4-chlorophenyl)methyl]-4-(dimethylaminomethyl)-3,4-dihydro-2H-1-benzothiepin-5-ol CAS Name: 5-[(4-chlorophenyl)methyl]-4-(dimethylaminomethyl)-3,4-dihydro-2H-1-benzothiepin-5-ol IUPAC Name: 5-[(4-chlorophenyl)methyl]-4-(dimethylaminomethyl)-3,4-dihydro-2H-1-benzothiepin-5-ol Traditional Name: 5-(4-chlorobenzyl)-4-(dimethylaminomethyl)-3,4-dihydro-2H-1-benzothiepin-5-ol Formula: C20H24ClNOS MolecularWeight: 361.92866

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCSC2=CC=CC=C2C1(CC3=CC=C(C=C3)Cl)O

Isomeric SMILES

CN(C)CC1CCSC2=CC=CC=C2C1(CC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C20H24ClNOS/c1-22(2)14-16-11-12-24-19-6-4-3-5-18(19)20(16,23)13-15-7-9-17(21)10-8-15/h3-10,16,23H,11-14H2,1-2H3