N-[3,5-bis(chloranyl)phenyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: N-[3,5-bis(chloranyl)phenyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: N-(3,5-dichlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: N-(3,5-dichlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: N-(3,5-dichlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: N-(3,5-dichlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C18H18Cl2N2O2S MolecularWeight: 397.31872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=S)NC3=CC(=CC(=C3)Cl)Cl)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=S)NC3=CC(=CC(=C3)Cl)Cl)OC

InChI

InChI=1S/C18H18Cl2N2O2S/c1-23-16-5-11-3-4-22(10-12(11)6-17(16)24-2)18(25)21-15-8-13(19)7-14(20)9-15/h5-9H,3-4,10H2,1-2H3,(H,21,25)