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

Systemtic Name: N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylsulfonyl-aniline Openeye Name: N-[(3,5-dimethylisoxazol-4-yl)methyl]-3-methylsulfonyl-aniline CAS Name: N-[(3,5-dimethyl-4-isoxazolyl)methyl]-3-methylsulfonylaniline IUPAC Name: N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylsulfonylaniline Traditional Name: (3,5-dimethylisoxazol-4-yl)methyl-(3-mesylphenyl)amine Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CNC2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=NO1)C)CNC2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C13H16N2O3S/c1-9-13(10(2)18-15-9)8-14-11-5-4-6-12(7-11)19(3,16)17/h4-7,14H,8H2,1-3H3