Vitas-M small molecule compound
5-[(2,4-dichlorophenoxy)methyl]-4-(2-methylphenyl)-2-(morpholin-4-ylmethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK678963
SMILES Clc1ccc(c(c1)Cl)OCc1nn(c(=S)n1c1ccccc1C)CN1CCOCC1
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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 C21H22Cl2N4O2S MW 465.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22Cl2N4O2S/c1-15-4-2-3-5-18(15)27-20(13-29-19-7-6-16(22)12-17(19)23)24-26(21(27)30)14-25-8-10-28-11-9-25/h2-7,12H,8-11,13-14H2,1H3InChIKey
FXOJASLMDOZLEM-UHFFFAOYSA-NSynonyms
5((24DICHLOROPHENOXY)METHYL)4(2METHYLPHENYL)2(MORPHOLIN4YLMETHYL)124TRIAZOLE3THIONE
5((24dichlorophenoxy)methyl)4(2methylphenyl)2(morpholin4ylmethyl)24dihydro3H124triazole3thione
CC1=CC=CC=C1N2C(=NN(C2=S)CN3CCOCC3)COC4=C(C=C(C=C4)Cl)Cl
InChI=1SC21H22Cl2N4O2Sc115423518(15)2720(1329197616(22)1217(19)23)2426(21(27)30)14258102811925h2712H8111314H21H3
MFCD03231157
ZINC000019848390
ZINC19848390
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