Vitas-M small molecule compound

N-(3,4-difluorophenyl)-2-({5-[(4-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

Catalog ID
STL041804
SMILES C=CCn1c(SCC(=O)Nc2ccc(c(c2)F)F)nnc1COc1ccc(cc1)C

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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 C21H20F2N4O2S MW 430.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F2N4O2S/c1-3-10-27-19(12-29-16-7-4-14(2)5-8-16)25-26-21(27)30-13-20(28)24-15-6-9-17(22)18(23)11-15/h3-9,11H,1,10,12-13H2,2H3,(H,24,28)
InChIKey
ATEXEDQNBZHBJZ-UHFFFAOYSA-N
Synonyms
849002-78-4
2((4allyl5((ptolyloxy)methyl)4H124triazol3yl)thio)N(34difluorophenyl)acetamide
849002784
CC1=CC=C(C=C1)OCC2=NN=C(N2CC=C)SCC(=O)NC3=CC(=C(C=C3)F)F
InChI=1SC21H20F2N4O2Sc13102719(1229167414(2)5816)252621(27)301320(28)24156917(22)18(23)1115h3911H1101213H22H3(H2428)
MFCD05680079
N(34difluorophenyl)2((5((4methylphenoxy)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
N(34DIFLUOROPHENYL)2((5((4METHYLPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(34DIFLUOROPHENYL)2((5(4METHYLPHENOXYMETHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(34DIFLUOROPHENYL)2(5((4METHYLPHENOXY)METHYL)4PROP2ENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002450340
ZINC02450340
ZINC2450340

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Available files

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