2-[4,5-bis(4-methylphenyl)-1,3-oxazol-2-yl]ethanethioic S-acid

Systemtic Name: 2-[4,5-bis(4-methylphenyl)-1,3-oxazol-2-yl]ethanethioic S-acid Openeye Name: 2-[4,5-bis(p-tolyl)oxazol-2-yl]ethanethioic S-acid CAS Name: 2-[4,5-bis(4-methylphenyl)-2-oxazolyl]ethanethioic S-acid IUPAC Name: 2-[4,5-bis(4-methylphenyl)-1,3-oxazol-2-yl]ethanethioic S-acid Traditional Name: 2-[4,5-bis(p-tolyl)oxazol-2-yl]thioacetic acid Formula: C19H17NO2S MolecularWeight: 323.40878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(OC(=N2)CC(=O)S)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(OC(=N2)CC(=O)S)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H17NO2S/c1-12-3-7-14(8-4-12)18-19(15-9-5-13(2)6-10-15)22-16(20-18)11-17(21)23/h3-10H,11H2,1-2H3,(H,21,23)