Vitas-M small molecule compound
4-{[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}benzoic acid
Catalog ID
STK735647
SMILES OC(=O)c1ccc(cc1)CSc1nnc(n1c1ccccc1)c1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H17N3O2S MW 387.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O2S/c26-21(27)18-13-11-16(12-14-18)15-28-22-24-23-20(17-7-3-1-4-8-17)25(22)19-9-5-2-6-10-19/h1-14H,15H2,(H,26,27)InChIKey
DOHGOFAURHEKQT-UHFFFAOYSA-NSynonyms
348593-21-5348593215
4(((45DIPHENYL4H124TRIAZOL3YL)SULFANYL)METHYL)BENZOICACID
4(((45diphenyl4H124triazol3yl)thio)methyl)benzoicacid
4((45DIPHENYL124TRIAZOL3YL)SULFANYLMETHYL)BENZOICACID
4(45DIPHENYL4H(124)TRIAZOL3YLSULFANYLMETHYL)BENZOICACID
C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=CC=C(C=C4)C(=O)O
InChI=1SC22H17N3O2Sc2621(27)18131116(121418)152822242320(177314817)25(22)1995261019h114H15H2(H2627)
MFCD01204122
ZINC000001446230
ZINC1446230
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