4-[2-(1,3-benzodioxol-5-ylsulfanyl)-5-methyl-phenyl]-1,2,3,6-tetrahydropyridine

Systemtic Name: 4-[2-(1,3-benzodioxol-5-ylsulfanyl)-5-methyl-phenyl]-1,2,3,6-tetrahydropyridine Openeye Name: 4-[2-(1,3-benzodioxol-5-ylsulfanyl)-5-methyl-phenyl]-1,2,3,6-tetrahydropyridine CAS Name: 4-[2-(1,3-benzodioxol-5-ylthio)-5-methylphenyl]-1,2,3,6-tetrahydropyridine IUPAC Name: 4-[2-(1,3-benzodioxol-5-ylsulfanyl)-5-methylphenyl]-1,2,3,6-tetrahydropyridine Traditional Name: 4-[2-(1,3-benzodioxol-5-ylthio)-5-methyl-phenyl]-1,2,3,6-tetrahydropyridine Formula: C19H19NO2S MolecularWeight: 325.42466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC2=CC3=C(C=C2)OCO3)C4=CCNCC4

Isomeric SMILES

CC1=CC(=C(C=C1)SC2=CC3=C(C=C2)OCO3)C4=CCNCC4

InChI

InChI=1S/C19H19NO2S/c1-13-2-5-19(16(10-13)14-6-8-20-9-7-14)23-15-3-4-17-18(11-15)22-12-21-17/h2-6,10-11,20H,7-9,12H2,1H3