N-(3-fluoranyl-4-methyl-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(3-fluoro-4-methylphenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C13H15FN4OS MolecularWeight: 294.347803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NN=CN2C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NN=CN2C)F

InChI

InChI=1S/C13H15FN4OS/c1-8-4-5-10(6-11(8)14)16-12(19)9(2)20-13-17-15-7-18(13)3/h4-7,9H,1-3H3,(H,16,19)