Vitas-M small molecule compound
N-methyl-4-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-amine
Catalog ID
STL008784
SMILES CNc1nc(nc(n1)N1CCCC1)n1cnc(n1)SCCOc1ccccc1
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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 C18H22N8OS MW 398.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N8OS/c1-19-15-21-16(25-9-5-6-10-25)23-17(22-15)26-13-20-18(24-26)28-12-11-27-14-7-3-2-4-8-14/h2-4,7-8,13H,5-6,9-12H2,1H3,(H,19,21,22,23)InChIKey
JDOCPPRUDFVASH-UHFFFAOYSA-NSynonyms
905759-11-7905759117
CNC1=NC(=NC(=N1)N2CCCC2)N3C=NC(=N3)SCCOC4=CC=CC=C4
InChI=1SC18H22N8OSc119152116(259561025)2317(2215)26132018(2426)28121127147324814h247813H56912H21H3(H19212223)
MFCD08746590
Nmethyl4(3((2phenoxyethyl)sulfanyl)1H124triazol1yl)6(pyrrolidin1yl)135triazin2amine
Nmethyl4(3((2phenoxyethyl)thio)1H124triazol1yl)6(pyrrolidin1yl)135triazin2amine
Nmethyl4(3(2phenoxyethylsulfanyl)124triazol1yl)6pyrrolidin1yl135triazin2amine
ZINC000009304263
ZINC09304263
ZINC9304263
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