N-[2-(4-chlorophenyl)ethyl]-8-oxidanyl-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-8-oxidanyl-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-8-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-8-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-8-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-8-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide Formula: C19H21ClN2OS MolecularWeight: 360.90084

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CN(C1)C(=S)NCCC3=CC=C(C=C3)Cl)C=C(C=C2)O

Isomeric SMILES

C1CC2=C(CN(C1)C(=S)NCCC3=CC=C(C=C3)Cl)C=C(C=C2)O

InChI

InChI=1S/C19H21ClN2OS/c20-17-6-3-14(4-7-17)9-10-21-19(24)22-11-1-2-15-5-8-18(23)12-16(15)13-22/h3-8,12,23H,1-2,9-11,13H2,(H,21,24)