2-[[(4S)-5-oxidanylidene-1,3-diphenyl-2-sulfanylidene-imidazolidin-4-yl]diazenyl]benzoic acid

Systemtic Name: 2-[[(4S)-5-oxidanylidene-1,3-diphenyl-2-sulfanylidene-imidazolidin-4-yl]diazenyl]benzoic acid Openeye Name: 2-[(4S)-5-oxo-1,3-diphenyl-2-thioxo-imidazolidin-4-yl]azobenzoic acid CAS Name: 2-[[(4S)-5-oxo-1,3-diphenyl-2-sulfanylidene-4-imidazolidinyl]azo]benzoic acid IUPAC Name: 2-[[(4S)-5-oxo-1,3-diphenyl-2-sulfanylideneimidazolidin-4-yl]diazenyl]benzoic acid Traditional Name: 2-[(4S)-5-keto-1,3-diphenyl-2-thioxo-imidazolidin-4-yl]azobenzoic acid Formula: C22H16N4O3S MolecularWeight: 416.45244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(C(=O)N(C2=S)C3=CC=CC=C3)N=NC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2[C@H](C(=O)N(C2=S)C3=CC=CC=C3)N=NC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C22H16N4O3S/c27-20-19(24-23-18-14-8-7-13-17(18)21(28)29)25(15-9-3-1-4-10-15)22(30)26(20)16-11-5-2-6-12-16/h1-14,19H,(H,28,29)/t19-/m1/s1