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

Systemtic Name: 3-[4-cyclopropyl-5-[(5-fluoranyl-2-methoxy-phenyl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-cyclopropyl-5-[(5-fluoro-2-methoxy-phenyl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-cyclopropyl-5-[(5-fluoro-2-methoxyphenyl)methylthio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-cyclopropyl-5-[(5-fluoro-2-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-cyclopropyl-5-[(5-fluoro-2-methoxy-benzyl)thio]-1,2,4-triazol-3-yl]propionamide Formula: C16H19FN4O2S MolecularWeight: 350.411063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)CSC2=NN=C(N2C3CC3)CCC(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)F)CSC2=NN=C(N2C3CC3)CCC(=O)N

InChI

InChI=1S/C16H19FN4O2S/c1-23-13-5-2-11(17)8-10(13)9-24-16-20-19-15(7-6-14(18)22)21(16)12-3-4-12/h2,5,8,12H,3-4,6-7,9H2,1H3,(H2,18,22)