4-phenyl-5-propan-2-ylsulfonyl-1,2-thiazol-3-one

Systemtic Name: 4-phenyl-5-propan-2-ylsulfonyl-1,2-thiazol-3-one Openeye Name: 5-isopropylsulfonyl-4-phenyl-isothiazol-3-one CAS Name: 4-phenyl-5-propan-2-ylsulfonyl-3-isothiazolone IUPAC Name: 4-phenyl-5-propan-2-ylsulfonyl-1,2-thiazol-3-one Traditional Name: 5-isopropylsulfonyl-4-phenyl-4-isothiazolin-3-one Formula: C12H13NO3S2 MolecularWeight: 283.36652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(C(=O)NS1)C2=CC=CC=C2

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(C(=O)NS1)C2=CC=CC=C2

InChI

InChI=1S/C12H13NO3S2/c1-8(2)18(15,16)12-10(11(14)13-17-12)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,13,14)