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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=NN=C2SCCC(=O)N

Isomeric SMILES

COC1=CC=CC(=C1)N2C=NN=C2SCCC(=O)N

InChI

InChI=1S/C12H14N4O2S/c1-18-10-4-2-3-9(7-10)16-8-14-15-12(16)19-6-5-11(13)17/h2-4,7-8H,5-6H2,1H3,(H2,13,17)