Vitas-M small molecule compound
4-[({[4-(2,3-dihydro-1H-inden-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid
Catalog ID
STK786314
SMILES O=C(Nc1ccc(cc1)C(=O)O)CSc1nnc(n1C1CCc2c1cccc2)c1ccncc1
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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 C25H21N5O3S MW 471.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O3S/c31-22(27-19-8-5-18(6-9-19)24(32)33)15-34-25-29-28-23(17-11-13-26-14-12-17)30(25)21-10-7-16-3-1-2-4-20(16)21/h1-6,8-9,11-14,21H,7,10,15H2,(H,27,31)(H,32,33)InChIKey
OQHKZVDRHVQLDC-UHFFFAOYSA-NSynonyms
893780-92-24((((4(23DIHYDRO1HINDEN1YL)5(4PYRIDINYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOICACID
4((((4(23DIHYDRO1HINDEN1YL)5(PYRIDIN4YL)4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOICACID
4((2((4(23dihydro1Hinden1yl)5pyridin4yl124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
4(2((4(23dihydro1Hinden1yl)5(pyridin4yl)4H124triazol3yl)thio)acetamido)benzoicacid
893780922
C1CC2=CC=CC=C2C1N3C(=NN=C3SCC(=O)NC4=CC=C(C=C4)C(=O)O)C5=CC=NC=C5
InChI=1SC25H21N5O3Sc3122(27198518(6919)24(32)33)153425292823(17111326141217)30(25)2110716312420(16)21h1689111421H71015H2(H2731)(H3233)
MFCD08532160
ZINC000009548038
ZINC000009548041
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