Vitas-M small molecule compound
2-chloro-5-[({[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid
Catalog ID
STL360239
SMILES CCn1c(SCC(=O)Nc2ccc(c(c2)C(=O)O)Cl)nnc1c1ccncc1
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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 C18H16ClN5O3S MW 417.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClN5O3S/c1-2-24-16(11-5-7-20-8-6-11)22-23-18(24)28-10-15(25)21-12-3-4-14(19)13(9-12)17(26)27/h3-9H,2,10H2,1H3,(H,21,25)(H,26,27)InChIKey
ITZYJIHGTATEET-UHFFFAOYSA-NSynonyms
2chloro5((((4ethyl5(pyridin4yl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
2CHLORO5((2((4ETHYL5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOICACID
CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)C(=O)O)C3=CC=NC=C3
InChI=1SC18H16ClN5O3Sc122416(1157208611)222318(24)281015(25)21123414(19)13(912)17(26)27h39H210H21H3(H2125)(H2627)
MFCD07396400
ZINC000009236083
ZINC9236083
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