[3-[5-(4-methylsulfonylphenyl)-4-phenyl-1,3-oxazol-2-yl]phenyl] N-methyl-N-oxidanyl-carbamodithioate

Systemtic Name: [3-[5-(4-methylsulfonylphenyl)-4-phenyl-1,3-oxazol-2-yl]phenyl] N-methyl-N-oxidanyl-carbamodithioate Openeye Name: [3-[5-(4-methylsulfonylphenyl)-4-phenyl-oxazol-2-yl]phenyl] N-hydroxy-N-methyl-carbamodithioate CAS Name: N-hydroxy-N-methylcarbamodithioic acid [3-[5-(4-methylsulfonylphenyl)-4-phenyl-2-oxazolyl]phenyl] ester IUPAC Name: [3-[5-(4-methylsulfonylphenyl)-4-phenyl-1,3-oxazol-2-yl]phenyl] N-hydroxy-N-methylcarbamodithioate Traditional Name: N-hydroxy-N-methyl-carbamodithioic acid [3-[5-(4-mesylphenyl)-4-phenyl-oxazol-2-yl]phenyl] ester Formula: C24H20N2O4S3 MolecularWeight: 496.6216

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)SC1=CC=CC(=C1)C2=NC(=C(O2)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4)O

Isomeric SMILES

CN(C(=S)SC1=CC=CC(=C1)C2=NC(=C(O2)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4)O

InChI

InChI=1S/C24H20N2O4S3/c1-26(27)24(31)32-19-10-6-9-18(15-19)23-25-21(16-7-4-3-5-8-16)22(30-23)17-11-13-20(14-12-17)33(2,28)29/h3-15,27H,1-2H3