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

Systemtic Name: 4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]benzenecarbothioamide Openeye Name: 4-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]benzenecarbothioamide CAS Name: 4-[(3,5-dimethyl-4-isoxazolyl)sulfonylamino]benzenecarbothioamide IUPAC Name: 4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]benzenecarbothioamide Traditional Name: 4-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]thiobenzamide Formula: C12H13N3O3S2 MolecularWeight: 311.37992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=S)N

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C12H13N3O3S2/c1-7-11(8(2)18-14-7)20(16,17)15-10-5-3-9(4-6-10)12(13)19/h3-6,15H,1-2H3,(H2,13,19)