2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-5-methyl-aniline

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-5-methyl-aniline Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-5-methyl-aniline CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-5-methylaniline IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-5-methylaniline Traditional Name: [2-[(3,5-dimethylisoxazol-4-yl)methylthio]-5-methyl-phenyl]amine Formula: C13H16N2OS MolecularWeight: 248.34394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC2=C(ON=C2C)C)N

Isomeric SMILES

CC1=CC(=C(C=C1)SCC2=C(ON=C2C)C)N

InChI

InChI=1S/C13H16N2OS/c1-8-4-5-13(12(14)6-8)17-7-11-9(2)15-16-10(11)3/h4-6H,7,14H2,1-3H3