N-(4-chloranyl-2,5-dimethoxy-phenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C18H19ClN2O2S MolecularWeight: 362.87366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)N2CCC3=CC=CC=C3C2)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)N2CCC3=CC=CC=C3C2)OC)Cl

InChI

InChI=1S/C18H19ClN2O2S/c1-22-16-10-15(17(23-2)9-14(16)19)20-18(24)21-8-7-12-5-3-4-6-13(12)11-21/h3-6,9-10H,7-8,11H2,1-2H3,(H,20,24)