3-[3-(triphenylmethyl)imidazol-4-yl]propanethioic S-acid

Systemtic Name: 3-[3-(triphenylmethyl)imidazol-4-yl]propanethioic S-acid Openeye Name: 3-(3-tritylimidazol-4-yl)propanethioic S-acid CAS Name: 3-[3-(triphenylmethyl)-4-imidazolyl]propanethioic S-acid IUPAC Name: 3-(3-tritylimidazol-4-yl)propanethioic S-acid Traditional Name: 3-(3-tritylimidazol-4-yl)thiopropionic acid Formula: C25H22N2OS MolecularWeight: 398.51998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=NC=C4CCC(=O)S

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=NC=C4CCC(=O)S

InChI

InChI=1S/C25H22N2OS/c28-24(29)17-16-23-18-26-19-27(23)25(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15,18-19H,16-17H2,(H,28,29)