4,5-diphenyl-1,3-oxazole; 7-sulfanylheptanoic acid

Systemtic Name: 4,5-diphenyl-1,3-oxazole; 7-sulfanylheptanoic acid Openeye Name: 4,5-diphenyloxazole; 7-sulfanylheptanoic acid CAS Name: 4,5-diphenyloxazole; 7-mercaptoheptanoic acid IUPAC Name: 4,5-diphenyl-1,3-oxazole; 7-sulfanylheptanoic acid Traditional Name: 4,5-diphenyloxazole; 7-mercaptoenanthic acid Formula: C22H25NO3S MolecularWeight: 383.5038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC=N2)C3=CC=CC=C3.C(CCCS)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC=N2)C3=CC=CC=C3.C(CCCS)CCC(=O)O

InChI

InChI=1S/C15H11NO.C7H14O2S/c1-3-7-12(8-4-1)14-15(17-11-16-14)13-9-5-2-6-10-13;8-7(9)5-3-1-2-4-6-10/h1-11H;10H,1-6H2,(H,8,9)