3-(2-methylsulfanylimidazol-1-yl)-N-[[6-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]benzamide

Systemtic Name: 3-(2-methylsulfanylimidazol-1-yl)-N-[[6-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]benzamide Openeye Name: 3-(2-methylsulfanylimidazol-1-yl)-N-[[6-(1,2,4-triazol-1-yl)-3-pyridyl]methyl]benzamide CAS Name: 3-[2-(methylthio)-1-imidazolyl]-N-[[6-(1,2,4-triazol-1-yl)-3-pyridinyl]methyl]benzamide IUPAC Name: 3-(2-methylsulfanylimidazol-1-yl)-N-[[6-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]benzamide Traditional Name: 3-[2-(methylthio)imidazol-1-yl]-N-[[6-(1,2,4-triazol-1-yl)-3-pyridyl]methyl]benzamide Formula: C19H17N7OS MolecularWeight: 391.44958

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CN1C2=CC=CC(=C2)C(=O)NCC3=CN=C(C=C3)N4C=NC=N4

Isomeric SMILES

CSC1=NC=CN1C2=CC=CC(=C2)C(=O)NCC3=CN=C(C=C3)N4C=NC=N4

InChI

InChI=1S/C19H17N7OS/c1-28-19-21-7-8-25(19)16-4-2-3-15(9-16)18(27)23-11-14-5-6-17(22-10-14)26-13-20-12-24-26/h2-10,12-13H,11H2,1H3,(H,23,27)