Vitas-M small molecule compound

(1Z)-4-methyl-2-(1H-1,2,4-triazol-1-yl)-1-(1,3,5-trimethyl-1H-pyrazol-4-yl)pent-1-en-3-one

Catalog ID
STK833123
SMILES CC(C(=O)/C(=C/c1c(C)nn(c1C)C)/n1ncnc1)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 C14H19N5O MW 273.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19N5O/c1-9(2)14(20)13(19-8-15-7-16-19)6-12-10(3)17-18(5)11(12)4/h6-9H,1-5H3/b13-6-
InChIKey
YSJWNKFKLCACKC-MLPAPPSSSA-N
Synonyms
312311-98-1
(1Z)4METHYL2(1H124TRIAZOL1YL)1(135TRIMETHYL1HPYRAZOL4YL)1PENTEN3ONE
(1Z)4methyl2(1H124triazol1yl)1(135trimethyl1Hpyrazol4yl)pent1en3one
(Z)4METHYL2(124)TRIAZOL1YL1(135TRIMETHYL1HPYRAZOL4YL)PENT1EN3ONE
(Z)4METHYL2(124TRIAZOL1YL)1(135TRIMETHYL4PYRAZOLYL)1PENTEN3ONE
(Z)4METHYL2(124TRIAZOL1YL)1(135TRIMETHYLPYRAZOL4YL)PENT1EN3ONE
(Z)4methyl2(1H124triazol1yl)1(135trimethyl1Hpyrazol4yl)pent1en3one
312311981
4METHYL2(1H124TRIAZOL1YL)1(135TRIMETHYL1HPYRAZOL4YL)1PENTEN3ONE
4PENTEN3ONE2METHYL5(135TRIMETHYLPYRAZOL4YL)4(124TRIAZOL1YL)
CC(C(=O)C(=Cc1c(C)nn(c1C)C)n1ncnc1)C
CC1=C(C(=NN1C)C)C=C(C(=O)C(C)C)N2C=NC=N2
InChI=1SC14H19N5Oc19(2)14(20)13(1981571619)61210(3)1718(5)11(12)4h69H15H3b136
MFCD00778831
ZINC000004844104
ZINC04844104
ZINC4844104

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.