N-[(2-methoxypyridin-3-yl)methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-[(2-methoxypyridin-3-yl)methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-[(2-methoxy-3-pyridyl)methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-[(2-methoxy-3-pyridinyl)methyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-[(2-methoxypyridin-3-yl)methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-[(2-methoxy-3-pyridyl)methyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C17H17N5O2S MolecularWeight: 355.41418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)CNC(=O)C2=CC=C(C=C2)CSC3=NC=NN3

Isomeric SMILES

COC1=C(C=CC=N1)CNC(=O)C2=CC=C(C=C2)CSC3=NC=NN3

InChI

InChI=1S/C17H17N5O2S/c1-24-16-14(3-2-8-18-16)9-19-15(23)13-6-4-12(5-7-13)10-25-17-20-11-21-22-17/h2-8,11H,9-10H2,1H3,(H,19,23)(H,20,21,22)