Vitas-M small molecule compound

4-[({[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid

Catalog ID
STK328836
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)O)nnc1c1cccnc1

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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 C19H17N5O3S MW 395.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O3S/c1-2-10-24-17(14-4-3-9-20-11-14)22-23-19(24)28-12-16(25)21-15-7-5-13(6-8-15)18(26)27/h2-9,11H,1,10,12H2,(H,21,25)(H,26,27)
InChIKey
XEVYWIBSEIDEIQ-UHFFFAOYSA-N
Synonyms
727419-68-3
4((((4(prop2en1yl)5(pyridin3yl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
4((2((4PROP2ENYL5PYRIDIN3YL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOICACID
727419683
C=CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)O)C3=CN=CC=C3
InChI=1SC19H17N5O3Sc12102417(14439201114)222319(24)281216(25)21157513(6815)18(26)27h2911H11012H2(H2125)(H2627)
MFCD05858905
ZINC000004384686
ZINC4384686

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Available files

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