Vitas-M small molecule compound
1-{[5-(4-tert-butylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-3,3-dimethylbutan-2-one
Catalog ID
STL042363
SMILES C=CCn1c(SCC(=O)C(C)(C)C)nnc1c1ccc(cc1)C(C)(C)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 C21H29N3OS MW 371.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N3OS/c1-8-13-24-18(15-9-11-16(12-10-15)20(2,3)4)22-23-19(24)26-14-17(25)21(5,6)7/h8-12H,1,13-14H2,2-7H3InChIKey
OSPUWZSOPSZCHZ-UHFFFAOYSA-NSynonyms
862104-54-91((4allyl5(4(tertbutyl)phenyl)4H124triazol3yl)thio)33dimethylbutan2one
1((5(4tertbutylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)33dimethylbutan2one
1((5(4TERTBUTYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)33DIMETHYLBUTAN2ONE
862104549
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)C(C)(C)C
InChI=1SC21H29N3OSc18132418(1591116(121015)20(23)4)222319(24)261417(25)21(56)7h812H11314H227H3
MFCD05686658
ZINC000005500057
ZINC05500057
ZINC5500057
Check stock
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