Vitas-M small molecule compound
ethyl ({5-[3-(2,4-dichlorophenoxy)propyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Catalog ID
STK467289
SMILES C=CCn1c(CCCOc2ccc(cc2Cl)Cl)nnc1SCC(=O)OCC
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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 C18H21Cl2N3O3S MW 430.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21Cl2N3O3S/c1-3-9-23-16(21-22-18(23)27-12-17(24)25-4-2)6-5-10-26-15-8-7-13(19)11-14(15)20/h3,7-8,11H,1,4-6,9-10,12H2,2H3InChIKey
RQRRJBLZAGMDRP-UHFFFAOYSA-NSynonyms
CCOC(=O)CSC1=NN=C(N1CC=C)CCCOC2=C(C=C(C=C2)Cl)Cl
ethyl((5(3(24dichlorophenoxy)propyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetate
ethyl2((5(3(24dichlorophenoxy)propyl)4prop2enyl124triazol3yl)sulfanyl)acetate
ETHYL2(5(3(24DICHLOROPHENOXY)PROPYL)4PROP2ENYL124TRIAZOL3YLTHIO)ACETATE
InChI=1SC18H21Cl2N3O3Sc1392316(212218(23)271217(24)2542)651026158713(19)1114(15)20h37811H14691012H22H3
MFCD06074742
ZINC000017096795
ZINC17096795
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