N-(1,3-benzodioxol-5-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(4-pyridylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-(pyridin-4-ylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(4-pyridylmethylthio)nicotinamide Formula: C19H15N3O3S MolecularWeight: 365.4057

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=C(N=CC=C3)SCC4=CC=NC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=C(N=CC=C3)SCC4=CC=NC=C4

InChI

InChI=1S/C19H15N3O3S/c23-18(22-14-3-4-16-17(10-14)25-12-24-16)15-2-1-7-21-19(15)26-11-13-5-8-20-9-6-13/h1-10H,11-12H2,(H,22,23)