1-[3-(3-fluoranyl-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]-3-methylsulfonyl-propan-1-amine

Systemtic Name: 1-[3-(3-fluoranyl-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]-3-methylsulfonyl-propan-1-amine Openeye Name: 1-[3-(3-fluoro-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]-3-methylsulfonyl-propan-1-amine CAS Name: 1-[3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-methylsulfonyl-1-propanamine IUPAC Name: 1-[3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-methylsulfonylpropan-1-amine Traditional Name: [1-[3-(3-fluoro-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]-3-mesyl-propyl]amine Formula: C13H16FN3O3S MolecularWeight: 313.347843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NOC(=N2)C(CCS(=O)(=O)C)N)F

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NOC(=N2)C(CCS(=O)(=O)C)N)F

InChI

InChI=1S/C13H16FN3O3S/c1-8-3-4-9(7-10(8)14)12-16-13(20-17-12)11(15)5-6-21(2,18)19/h3-4,7,11H,5-6,15H2,1-2H3