6-chloranyl-N-[2-(4-chlorophenyl)ethyl]-8-methoxy-7-oxidanyl-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide

Systemtic Name: 6-chloranyl-N-[2-(4-chlorophenyl)ethyl]-8-methoxy-7-oxidanyl-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide Openeye Name: 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide CAS Name: 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide IUPAC Name: 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide Traditional Name: 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide Formula: C20H22Cl2N2O2S MolecularWeight: 425.37188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2CCCN(CC2=C1)C(=S)NCCC3=CC=C(C=C3)Cl)Cl)O

Isomeric SMILES

COC1=C(C(=C2CCCN(CC2=C1)C(=S)NCCC3=CC=C(C=C3)Cl)Cl)O

InChI

InChI=1S/C20H22Cl2N2O2S/c1-26-17-11-14-12-24(10-2-3-16(14)18(22)19(17)25)20(27)23-9-8-13-4-6-15(21)7-5-13/h4-7,11,25H,2-3,8-10,12H2,1H3,(H,23,27)