Vitas-M small molecule compound
2-{[5-(4-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(propan-2-yl)phenyl]acetamide
Catalog ID
STK697003
SMILES C=CCn1c(SCC(=O)Nc2ccccc2C(C)C)nnc1c1ccc(cc1)F
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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 C22H23FN4OS MW 410.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23FN4OS/c1-4-13-27-21(16-9-11-17(23)12-10-16)25-26-22(27)29-14-20(28)24-19-8-6-5-7-18(19)15(2)3/h4-12,15H,1,13-14H2,2-3H3,(H,24,28)InChIKey
UWWCWQMHHBEPJO-UHFFFAOYSA-NSynonyms
899405-87-92((4allyl5(4fluorophenyl)4H124triazol3yl)thio)N(2isopropylphenyl)acetamide
2((5(4fluorophenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(2(propan2yl)phenyl)acetamide
2((5(4FLUOROPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(2PROPAN2YLPHENYL)ACETAMIDE
2(5(4FLUOROPHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))N(2(METHYLETHYL)PHENYL)ACETAMIDE
899405879
CC(C)C1=CC=CC=C1NC(=O)CSC2=NN=C(N2CC=C)C3=CC=C(C=C3)F
InChI=1SC22H23FN4OSc14132721(1691117(23)121016)252622(27)291420(28)2419865718(19)15(2)3h41215H11314H223H3(H2428)
MFCD05540599
ZINC000002346522
ZINC02346522
ZINC2346522
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