7-(2,4,5-triphenylimidazol-1-yl)heptanethioic S-acid

Systemtic Name: 7-(2,4,5-triphenylimidazol-1-yl)heptanethioic S-acid Openeye Name: 7-(2,4,5-triphenylimidazol-1-yl)heptanethioic S-acid CAS Name: 7-(2,4,5-triphenyl-1-imidazolyl)heptanethioic S-acid IUPAC Name: 7-(2,4,5-triphenylimidazol-1-yl)heptanethioic S-acid Traditional Name: 7-(2,4,5-triphenylimidazol-1-yl)thioenanthic acid Formula: C28H28N2OS MolecularWeight: 440.59972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(C(=N2)C3=CC=CC=C3)CCCCCCC(=O)S)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(C(=N2)C3=CC=CC=C3)CCCCCCC(=O)S)C4=CC=CC=C4

InChI

InChI=1S/C28H28N2OS/c31-25(32)20-12-1-2-13-21-30-27(23-16-8-4-9-17-23)26(22-14-6-3-7-15-22)29-28(30)24-18-10-5-11-19-24/h3-11,14-19H,1-2,12-13,20-21H2,(H,31,32)