Vitas-M small molecule compound

1-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)propan-2-one

Catalog ID
STK572802
SMILES COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)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 C15H16N6O2S MW 344.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N6O2S/c1-9(22)8-24-15-20-19-14(21(15)16)13-7-12(17-18-13)10-3-5-11(23-2)6-4-10/h3-7H,8,16H2,1-2H3,(H,17,18)
InChIKey
UOFBVMYRAMEVCY-UHFFFAOYSA-N
Synonyms
879442-37-2
1((4AMINO5(3(4METHOXYPHENYL)1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)PROPAN2ONE
1((4amino5(3(4methoxyphenyl)1Hpyrazol5yl)4H124triazol3yl)thio)propan2one
1((4amino5(5(4methoxyphenyl)1Hpyrazol3yl)4H124triazol3yl)sulfanyl)propan2one
1(4AMINO5(3(4METHOXYPHENYL)PYRAZOL5YL)124TRIAZOL3YLTHIO)ACETONE
879442372
CC(=O)CSC1=NN=C(N1N)C2=CC(=NN2)C3=CC=C(C=C3)OC
COc1ccc(cc1)c1(nH)nc(c1)c1nnc(n1N)SCC(=O)C
COc1ccc(cc1)c1n(nH)c(c1)c1nnc(n1N)SCC(=O)C
InChI=1SC15H16N6O2Sc19(22)82415201914(21(15)16)13712(171813)103511(232)6410h37H816H212H3(H1718)
MFCD07201454
ZINC000009110380
ZINC09110380
ZINC9110380

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Available files

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