N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-methyl-2-(phenylthio)-N-piperonyl-nicotinamide Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C21H18N2O3S/c1-23(13-15-9-10-18-19(12-15)26-14-25-18)21(24)17-8-5-11-22-20(17)27-16-6-3-2-4-7-16/h2-12H,13-14H2,1H3