N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-3,4-dihydro-2H-quinoline-1-carbothioamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-3,4-dihydro-2H-quinoline-1-carbothioamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-3,4-dihydro-2H-quinoline-1-carbothioamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-3,4-dihydro-2H-quinoline-1-carbothioamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-3,4-dihydro-2H-quinoline-1-carbothioamide Traditional Name: 6-methyl-N-piperonyl-3,4-dihydro-2H-quinoline-1-carbothioamide Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CCC2)C(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC2=C(C=C1)N(CCC2)C(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H20N2O2S/c1-13-4-6-16-15(9-13)3-2-8-21(16)19(24)20-11-14-5-7-17-18(10-14)23-12-22-17/h4-7,9-10H,2-3,8,11-12H2,1H3,(H,20,24)