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

Systemtic Name: 9-chloranyl-N-[2-(4-chlorophenyl)ethyl]-8-oxidanyl-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide Openeye Name: 9-chloro-N-[2-(4-chlorophenyl)ethyl]-8-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide CAS Name: 9-chloro-N-[2-(4-chlorophenyl)ethyl]-8-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide IUPAC Name: 9-chloro-N-[2-(4-chlorophenyl)ethyl]-8-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide Traditional Name: 9-chloro-N-[2-(4-chlorophenyl)ethyl]-8-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide Formula: C19H20Cl2N2OS MolecularWeight: 395.3459

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H20Cl2N2OS/c20-15-6-3-13(4-7-15)9-10-22-19(25)23-11-1-2-14-5-8-17(24)18(21)16(14)12-23/h3-8,24H,1-2,9-12H2,(H,22,25)