Vitas-M small molecule compound
2-chloro-5-[({[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid
Catalog ID
STL360257
SMILES C=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 C19H16ClN5O3S MW 429.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN5O3S/c1-2-9-25-17(12-5-7-21-8-6-12)23-24-19(25)29-11-16(26)22-13-3-4-15(20)14(10-13)18(27)28/h2-8,10H,1,9,11H2,(H,22,26)(H,27,28)InChIKey
IATPWXQBTVYLBZ-UHFFFAOYSA-NSynonyms
2chloro5((((4(prop2en1yl)5(pyridin4yl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
2CHLORO5((2((4PROP2ENYL5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOICACID
C=CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)C(=O)O)C3=CC=NC=C3
InChI=1SC19H16ClN5O3Sc1292517(1257218612)232419(25)291116(26)22133415(20)14(1013)18(27)28h2810H1911H2(H2226)(H2728)
MFCD07396404
ZINC000009236081
ZINC9236081
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