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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carbothioamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carbothioamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carbothioamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-phenyl-3,6-dihydro-2H-pyridine-1-carbothioamide Traditional Name: 4-phenyl-N-piperonyl-3,6-dihydro-2H-pyridine-1-carbothioamide Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CC=CC=C2)C(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CC=C1C2=CC=CC=C2)C(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20N2O2S/c25-20(21-13-15-6-7-18-19(12-15)24-14-23-18)22-10-8-17(9-11-22)16-4-2-1-3-5-16/h1-8,12H,9-11,13-14H2,(H,21,25)