[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-3,5-dimethyl-phenyl] thiocyanate

Systemtic Name: [4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-3,5-dimethyl-phenyl] thiocyanate Openeye Name: [4-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]-3,5-dimethyl-phenyl] thiocyanate CAS Name: thiocyanic acid [4-[(3,5-dimethyl-4-isoxazolyl)sulfonylamino]-3,5-dimethylphenyl] ester IUPAC Name: [4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-3,5-dimethylphenyl] thiocyanate Traditional Name: thiocyanic acid [4-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]-3,5-dimethyl-phenyl] ester Formula: C14H15N3O3S2 MolecularWeight: 337.4172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NS(=O)(=O)C2=C(ON=C2C)C)C)SC#N

Isomeric SMILES

CC1=CC(=CC(=C1NS(=O)(=O)C2=C(ON=C2C)C)C)SC#N

InChI

InChI=1S/C14H15N3O3S2/c1-8-5-12(21-7-15)6-9(2)13(8)17-22(18,19)14-10(3)16-20-11(14)4/h5-6,17H,1-4H3