2-[[4,5-bis(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[4,5-bis(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[4,5-bis(3-bromophenyl)oxazol-2-yl]sulfanylacetic acid CAS Name: 2-[[4,5-bis(3-bromophenyl)-2-oxazolyl]thio]acetic acid IUPAC Name: 2-[[4,5-bis(3-bromophenyl)-1,3-oxazol-2-yl]sulfanyl]acetic acid Traditional Name: 2-[[4,5-bis(3-bromophenyl)oxazol-2-yl]thio]acetic acid Formula: C17H11Br2NO3S MolecularWeight: 469.14714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=C(OC(=N2)SCC(=O)O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=C(OC(=N2)SCC(=O)O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H11Br2NO3S/c18-12-5-1-3-10(7-12)15-16(11-4-2-6-13(19)8-11)23-17(20-15)24-9-14(21)22/h1-8H,9H2,(H,21,22)