Vitas-M small molecule compound
5-{5-[(4-chloro-2-methylphenoxy)methyl]furan-2-yl}-4-[3-(morpholin-4-yl)propyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STL173932
SMILES Clc1ccc(c(c1)C)OCc1ccc(o1)c1nnc(n1CCCN1CCOCC1)S
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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 C21H25ClN4O3S MW 448.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN4O3S/c1-15-13-16(22)3-5-18(15)28-14-17-4-6-19(29-17)20-23-24-21(30)26(20)8-2-7-25-9-11-27-12-10-25/h3-6,13H,2,7-12,14H2,1H3,(H,24,30)InChIKey
GQUBCGPZSGBZBG-UHFFFAOYSA-NSynonyms
828290-81-93(5((4CHLORO2METHYLPHENOXY)METHYL)FURAN2YL)4(3MORPHOLIN4YLPROPYL)1H124TRIAZOLE5THIONE
5(5((4chloro2methylphenoxy)methyl)furan2yl)4(3(morpholin4yl)propyl)4H124triazole3thiol
5(5((4CHLORO2METHYLPHENOXY)METHYL)FURAN2YL)4(3MORPHOLIN4YLPROPYL)24DIHYDRO3H124TRIAZOLE3THIONE
828290819
CC1=C(C=CC(=C1)Cl)OCC2=CC=C(O2)C3=NNC(=S)N3CCCN4CCOCC4
InChI=1SC21H25ClN4O3Sc1151316(22)3518(15)2814174619(2917)20232421(30)26(20)8272591127121025h3613H271214H21H3(H2430)
MFCD04130594
ZINC000002793308
ZINC2793308
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