N-(3-chloranyl-4-methoxy-phenyl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-(4-pyridylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-(pyridin-4-ylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2-(4-pyridylmethylthio)nicotinamide Formula: C19H16ClN3O2S MolecularWeight: 385.86724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=NC=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=NC=C3)Cl

InChI

InChI=1S/C19H16ClN3O2S/c1-25-17-5-4-14(11-16(17)20)23-18(24)15-3-2-8-22-19(15)26-12-13-6-9-21-10-7-13/h2-11H,12H2,1H3,(H,23,24)