3-[5-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[5-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[(5-acetyl-2-methoxyphenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[(5-acetyl-2-methoxy-benzyl)thio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NN=C(N2C)CCC(=O)N

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NN=C(N2C)CCC(=O)N

InChI

InChI=1S/C16H20N4O3S/c1-10(21)11-4-5-13(23-3)12(8-11)9-24-16-19-18-15(20(16)2)7-6-14(17)22/h4-5,8H,6-7,9H2,1-3H3,(H2,17,22)