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

Systemtic Name: N-[(3-methoxyphenyl)methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-[(3-methoxyphenyl)methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-[(3-methoxyphenyl)methyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-m-anisyl-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C2=CC=C(C=C2)CSC3=NC=NN3

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C2=CC=C(C=C2)CSC3=NC=NN3

InChI

InChI=1S/C18H18N4O2S/c1-24-16-4-2-3-14(9-16)10-19-17(23)15-7-5-13(6-8-15)11-25-18-20-12-21-22-18/h2-9,12H,10-11H2,1H3,(H,19,23)(H,20,21,22)