Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclopentylpropanamide
Catalog ID
STL122600
SMILES O=C(C(Sc1nnc(n1C(C)C)c1cc2c(o1)cccc2)C)NC1CCCC1
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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 C21H26N4O2S MW 398.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O2S/c1-13(2)25-19(18-12-15-8-4-7-11-17(15)27-18)23-24-21(25)28-14(3)20(26)22-16-9-5-6-10-16/h4,7-8,11-14,16H,5-6,9-10H2,1-3H3,(H,22,26)InChIKey
ARFRDABBJOYFRU-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4(propan2yl)4H124triazol3yl)sulfanyl)Ncyclopentylpropanamide
2((5(1benzofuran2yl)4propan2yl124triazol3yl)sulfanyl)Ncyclopentylpropanamide
CC(C)N1C(=NN=C1SC(C)C(=O)NC2CCCC2)C3=CC4=CC=CC=C4O3
InChI=1SC21H26N4O2Sc113(2)2519(1812158471117(15)2718)232421(25)2814(3)20(26)22169561016h478111416H56910H213H3(H2226)
MFCD17011697
ZINC000020171755
ZINC000020171756
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