N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-(4-pyridylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-2-(pyridin-4-ylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-2-(4-pyridylmethylthio)nicotinamide Formula: C20H16N4OS3 MolecularWeight: 424.56224

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=C(N=CC=C3)SCC4=CC=NC=C4

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=C(N=CC=C3)SCC4=CC=NC=C4

InChI

InChI=1S/C20H16N4OS3/c1-26-20-24-16-5-4-14(11-17(16)28-20)23-18(25)15-3-2-8-22-19(15)27-12-13-6-9-21-10-7-13/h2-11H,12H2,1H3,(H,23,25)