Vitas-M small molecule compound

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

Catalog ID
STK594171
SMILES COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(c(c1)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 C22H23N7O2S MW 449.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N7O2S/c1-13-4-7-16(10-14(13)2)24-20(30)12-32-22-28-27-21(29(22)23)19-11-18(25-26-19)15-5-8-17(31-3)9-6-15/h4-11H,12,23H2,1-3H3,(H,24,30)(H,25,26)
InChIKey
NUNXNHSTRVTSBM-UHFFFAOYSA-N
Synonyms
1039030-25-5
1039030255
2((4AMINO5(3(4METHOXYPHENYL)1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)N(34DIMETHYLPHENYL)ACETAMIDE
2((4amino5(3(4methoxyphenyl)1Hpyrazol5yl)4H124triazol3yl)thio)N(34dimethylphenyl)acetamide
2((4amino5(5(4methoxyphenyl)1Hpyrazol3yl)4H124triazol3yl)sulfanyl)N(34dimethylphenyl)acetamide
2(4AMINO5(3(4METHOXYPHENYL)PYRAZOL5YL)(124TRIAZOL3YLTHIO))N(34DIMETHYLPHENYL)ACETAMIDE
CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2N)C3=CC(=NN3)C4=CC=C(C=C4)OC)C
COc1ccc(cc1)c1(nH)nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(c(c1)C)C
COc1ccc(cc1)c1n(nH)c(c1)c1nnc(n1N)SCC(=O)Nc1ccc(c(c1)C)C
InChI=1SC22H23N7O2Sc1134716(1014(13)2)2420(30)123222282721(29(22)23)191118(252619)155817(313)9615h411H1223H213H3(H2430)(H2526)
MFCD07198432
ZINC000009330929
ZINC09330929
ZINC9330929

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Available files

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