3-[[1-(4-bromophenyl)-4-phenyl-6-sulfanylidene-1,3,5-triazin-2-yl]sulfanyl]-3-phenyl-propanoic acid

Systemtic Name: 3-[[1-(4-bromophenyl)-4-phenyl-6-sulfanylidene-1,3,5-triazin-2-yl]sulfanyl]-3-phenyl-propanoic acid Openeye Name: 3-[[1-(4-bromophenyl)-4-phenyl-6-thioxo-1,3,5-triazin-2-yl]sulfanyl]-3-phenyl-propanoic acid CAS Name: 3-[[1-(4-bromophenyl)-4-phenyl-6-sulfanylidene-1,3,5-triazin-2-yl]thio]-3-phenylpropanoic acid IUPAC Name: 3-[[1-(4-bromophenyl)-4-phenyl-6-sulfanylidene-1,3,5-triazin-2-yl]sulfanyl]-3-phenylpropanoic acid Traditional Name: 3-[[1-(4-bromophenyl)-4-phenyl-6-thioxo-s-triazin-2-yl]thio]-3-phenyl-propionic acid Formula: C24H18BrN3O2S2 MolecularWeight: 524.45262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=S)N(C(=N2)SC(CC(=O)O)C3=CC=CC=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=S)N(C(=N2)SC(CC(=O)O)C3=CC=CC=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H18BrN3O2S2/c25-18-11-13-19(14-12-18)28-23(31)26-22(17-9-5-2-6-10-17)27-24(28)32-20(15-21(29)30)16-7-3-1-4-8-16/h1-14,20H,15H2,(H,29,30)