Vitas-M small molecule compound
4-[({[4-(4-methylphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid
Catalog ID
STL182586
SMILES O=C(Nc1ccc(cc1)C(=O)O)CSc1nnc(n1c1ccc(cc1)C)c1cccnc1
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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 C23H19N5O3S MW 445.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N5O3S/c1-15-4-10-19(11-5-15)28-21(17-3-2-12-24-13-17)26-27-23(28)32-14-20(29)25-18-8-6-16(7-9-18)22(30)31/h2-13H,14H2,1H3,(H,25,29)(H,30,31)InChIKey
FCDCIJVKXSGTGI-UHFFFAOYSA-NSynonyms
4((((4(4methylphenyl)5(pyridin3yl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
4((2((4(4methylphenyl)5pyridin3yl124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)C(=O)O)C4=CN=CC=C4
InChI=1SC23H19N5O3Sc11541019(11515)2821(173212241317)262723(28)321420(29)25188616(7918)22(30)31h213H14H21H3(H2529)(H3031)
MFCD22125497
ZINC000072191571
ZINC72191571
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