2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: 2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C12H14N4O2S MolecularWeight: 278.33016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)SC1=NNC(=N1)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C(=O)N)SC1=NNC(=N1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C12H14N4O2S/c1-7(10(13)17)19-12-14-11(15-16-12)8-3-5-9(18-2)6-4-8/h3-7H,1-2H3,(H2,13,17)(H,14,15,16)