Vitas-M small molecule compound
2-{[5-(5-chloro-1-benzofuran-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopentylacetamide
Catalog ID
STK245697
SMILES C=CCn1c(SCC(=O)NC2CCCC2)nnc1c1cc2c(o1)ccc(c2)Cl
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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 C20H21ClN4O2S MW 416.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN4O2S/c1-2-9-25-19(17-11-13-10-14(21)7-8-16(13)27-17)23-24-20(25)28-12-18(26)22-15-5-3-4-6-15/h2,7-8,10-11,15H,1,3-6,9,12H2,(H,22,26)InChIKey
NTFRKBANUKUFEO-UHFFFAOYSA-NSynonyms
2((5(5CHLORO1BENZOFURAN2YL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)NCYCLOPENTYLACETAMIDE
2((5(5chloro1benzofuran2yl)4prop2enyl124triazol3yl)sulfanyl)Ncyclopentylacetamide
2(4ALLYL5(5CHLOROBENZOFURAN2YL)4H(124)TRIAZOL3YLSULFANYL)NCYCLOPENTYLACETAMIDE
C=CCN1C(=NN=C1SCC(=O)NC2CCCC2)C3=CC4=C(O3)C=CC(=C4)Cl
InChI=1SC20H21ClN4O2Sc1292519(1711131014(21)7816(13)2717)232420(25)281218(26)2215534615h278101115H136912H2(H2226)
MFCD08670372
ZINC000009327851
ZINC09327851
ZINC9327851
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