1,1-bis(oxidanylidene)-2-(phenylsulfanylmethyl)-4-propan-2-yl-1,2-benzothiazol-3-one

Systemtic Name: 1,1-bis(oxidanylidene)-2-(phenylsulfanylmethyl)-4-propan-2-yl-1,2-benzothiazol-3-one Openeye Name: 4-isopropyl-1,1-dioxo-2-(phenylsulfanylmethyl)-1,2-benzothiazol-3-one CAS Name: 1,1-dioxo-2-[(phenylthio)methyl]-4-propan-2-yl-1,2-benzothiazol-3-one IUPAC Name: 1,1-dioxo-2-(phenylsulfanylmethyl)-4-propan-2-yl-1,2-benzothiazol-3-one Traditional Name: 4-isopropyl-1,1-diketo-2-[(phenylthio)methyl]-1,2-benzothiazol-3-one Formula: C17H17NO3S2 MolecularWeight: 347.45178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)S(=O)(=O)N(C2=O)CSC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)S(=O)(=O)N(C2=O)CSC3=CC=CC=C3

InChI

InChI=1S/C17H17NO3S2/c1-12(2)14-9-6-10-15-16(14)17(19)18(23(15,20)21)11-22-13-7-4-3-5-8-13/h3-10,12H,11H2,1-2H3