Vitas-M small molecule compound

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

Catalog ID
STK581932
SMILES CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1cc([nH]n1)c1ccc(cc1)F)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 C23H24FN7OS MW 465.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24FN7OS/c1-3-14(2)15-6-10-18(11-7-15)26-21(32)13-33-23-30-29-22(31(23)25)20-12-19(27-28-20)16-4-8-17(24)9-5-16/h4-12,14H,3,13,25H2,1-2H3,(H,26,32)(H,27,28)
InChIKey
PNRJZGLXMCGTTC-UHFFFAOYSA-N
Synonyms
879456-16-3
2((4AMINO5(3(4FLUOROPHENYL)1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)N(4BUTAN2YLPHENYL)ACETAMIDE
2((4amino5(3(4fluorophenyl)1Hpyrazol5yl)4H124triazol3yl)thio)N(4(secbutyl)phenyl)acetamide
2((4amino5(5(4fluorophenyl)1Hpyrazol3yl)4H124triazol3yl)sulfanyl)N(4(butan2yl)phenyl)acetamide
2(4AMINO5(3(4FLUOROPHENYL)PYRAZOL5YL)(124TRIAZOL3YLTHIO))N(4(METHYLPROPYL)PHENYL)ACETAMIDE
879456163
CCC(C)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2N)C3=CC(=NN3)C4=CC=C(C=C4)F
CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1(nH)nc(c1)c1ccc(cc1)F)C
CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1cc((nH)n1)c1ccc(cc1)F)C
InChI=1SC23H24FN7OSc1314(2)1561018(11715)2621(32)133323302922(31(23)25)201219(272820)164817(24)9516h41214H31325H212H3(H2632)(H2728)
MFCD07203796
ZINC000009450501
ZINC000009450505

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Available files

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