6-chloranyl-N-[2-(4-chlorophenyl)ethyl]-7-oxidanyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: 6-chloranyl-N-[2-(4-chlorophenyl)ethyl]-7-oxidanyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C18H18Cl2N2OS MolecularWeight: 381.31932

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC(=C(C=C21)Cl)O)C(=S)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CC2=CC(=C(C=C21)Cl)O)C(=S)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18Cl2N2OS/c19-15-3-1-12(2-4-15)5-7-21-18(24)22-8-6-13-9-16(20)17(23)10-14(13)11-22/h1-4,9-10,23H,5-8,11H2,(H,21,24)