3-[2-phenylazanyl-4-(4-phenylphenyl)-1,3-thiazol-3-ium-3-yl]propanoic acid

Systemtic Name: 3-[2-phenylazanyl-4-(4-phenylphenyl)-1,3-thiazol-3-ium-3-yl]propanoic acid Openeye Name: 3-[2-anilino-4-(4-phenylphenyl)thiazol-3-ium-3-yl]propanoic acid CAS Name: 3-[2-anilino-4-(4-phenylphenyl)-3-thiazol-3-iumyl]propanoic acid IUPAC Name: 3-[2-anilino-4-(4-phenylphenyl)-1,3-thiazol-3-ium-3-yl]propanoic acid Traditional Name: 3-[2-anilino-4-(4-phenylphenyl)thiazol-3-ium-3-yl]propionic acid Formula: C24H21N2O2S+ MolecularWeight: 401.50074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CSC(=[N+]3CCC(=O)O)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CSC(=[N+]3CCC(=O)O)NC4=CC=CC=C4

InChI

InChI=1S/C24H20N2O2S/c27-23(28)15-16-26-22(17-29-24(26)25-21-9-5-2-6-10-21)20-13-11-19(12-14-20)18-7-3-1-4-8-18/h1-14,17H,15-16H2,(H,27,28)/p+1