Vitas-M small molecule compound
2-fluoro-N-{4-[5-({2-[(2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]phenyl}benzamide
Catalog ID
STL333433
SMILES COc1ccccc1NC(=O)CSc1nnc(n1C)c1ccc(cc1)NC(=O)c1ccccc1F
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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 C25H22FN5O3S MW 491.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22FN5O3S/c1-31-23(16-11-13-17(14-12-16)27-24(33)18-7-3-4-8-19(18)26)29-30-25(31)35-15-22(32)28-20-9-5-6-10-21(20)34-2/h3-14H,15H2,1-2H3,(H,27,33)(H,28,32)InChIKey
NGPNITYSDOYFLB-UHFFFAOYSA-NSynonyms
445421-47-62fluoroN(4(5((2((2methoxyphenyl)amino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)phenyl)benzamide
2fluoroN(4(5((2((2methoxyphenyl)amino)2oxoethyl)thio)4methyl4H124triazol3yl)phenyl)benzamide
2FLUORON(4(5((2(2METHOXYANILINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)PHENYL)BENZAMIDE
2FLUORON(4(5(2(2METHOXYANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)PHENYL)BENZAMIDE
445421476
CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2OC)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4F
InChI=1SC25H22FN5O3Sc13123(16111317(141216)2724(33)18734819(18)26)293025(31)351522(32)28209561021(20)342h314H15H212H3(H2733)(H2832)
MFCD03079890
ZINC000000680506
ZINC00680506
ZINC680506
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