4-cyclopropyl-3-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-cyclopropyl-3-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 3-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-4-cyclopropyl-1H-1,2,4-triazol-5-one CAS Name: 3-[(5-acetyl-2-methoxyphenyl)methylthio]-4-cyclopropyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-4-cyclopropyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[(5-acetyl-2-methoxy-benzyl)thio]-4-cyclopropyl-1H-1,2,4-triazol-5-one Formula: C15H17N3O3S MolecularWeight: 319.37878

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NNC(=O)N2C3CC3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NNC(=O)N2C3CC3

InChI

InChI=1S/C15H17N3O3S/c1-9(19)10-3-6-13(21-2)11(7-10)8-22-15-17-16-14(20)18(15)12-4-5-12/h3,6-7,12H,4-5,8H2,1-2H3,(H,16,20)