Vitas-M small molecule compound
3-(4-tert-butylphenyl)-4-ethyl-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole
Catalog ID
STK582875
SMILES CCn1c(SC/C=C/c2ccccc2)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 C23H27N3S MW 377.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3S/c1-5-26-21(19-13-15-20(16-14-19)23(2,3)4)24-25-22(26)27-17-9-12-18-10-7-6-8-11-18/h6-16H,5,17H2,1-4H3/b12-9+InChIKey
BIBZRPALMWFRAY-FMIVXFBMSA-NSynonyms
896069-55-93((2E)3PHENYLPROP2ENYLTHIO)5(4(TERTBUTYL)PHENYL)4ETHYL124TRIAZOLE
3(4(tertbutyl)phenyl)5(cinnamylthio)4ethyl4H124triazole
3(4tertbutylphenyl)4ethyl5(((2E)3phenylprop2en1yl)sulfanyl)4H124triazole
3(4TERTBUTYLPHENYL)4ETHYL5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOLE
896069559
CCN1C(=NN=C1SCC=CC2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C
CCn1c(SCC=Cc2ccccc2)nnc1c1ccc(cc1)C(C)(C)C
InChI=1SC23H27N3Sc152621(19131520(161419)23(23)4)242522(26)271791218107681118h616H517H214H3b129+
MFCD06591606
ZINC000002443923
ZINC02443923
ZINC2443923
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