N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethylphenyl)sulfanyl-N-methyl-pyridine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethylphenyl)sulfanyl-N-methyl-pyridine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethylphenyl)sulfanyl-N-methyl-pyridine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,4-dimethylphenyl)thio]-N-methyl-3-pyridinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethylphenyl)sulfanyl-N-methylpyridine-3-carboxamide Traditional Name: 2-[(3,4-dimethylphenyl)thio]-N-methyl-N-piperonyl-nicotinamide Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)N(C)CC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)N(C)CC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C23H22N2O3S/c1-15-6-8-18(11-16(15)2)29-22-19(5-4-10-24-22)23(26)25(3)13-17-7-9-20-21(12-17)28-14-27-20/h4-12H,13-14H2,1-3H3