Vitas-M small molecule compound

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

Catalog ID
STK572044
SMILES O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

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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 C19H14ClF2N7OS MW 461.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14ClF2N7OS/c20-11-3-1-10(2-4-11)15-8-16(26-25-15)18-27-28-19(29(18)23)31-9-17(30)24-12-5-6-13(21)14(22)7-12/h1-8H,9,23H2,(H,24,30)(H,25,26)
InChIKey
RLEJBAWMKAANEK-UHFFFAOYSA-N
Synonyms
879460-43-2
2((4AMINO5(3(4CHLOROPHENYL)1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)N(34DIFLUOROPHENYL)ACETAMIDE
2((4amino5(3(4chlorophenyl)1Hpyrazol5yl)4H124triazol3yl)thio)N(34difluorophenyl)acetamide
2((4amino5(5(4chlorophenyl)1Hpyrazol3yl)4H124triazol3yl)sulfanyl)N(34difluorophenyl)acetamide
2(4AMINO5(3(4CHLOROPHENYL)PYRAZOL5YL)(124TRIAZOL3YLTHIO))N(34DIFLUOROPHENYL)ACETAMIDE
879460432
C1=CC(=CC=C1C2=NNC(=C2)C3=NN=C(N3N)SCC(=O)NC4=CC(=C(C=C4)F)F)Cl
InChI=1SC19H14ClF2N7OSc20113110(2411)15816(262515)18272819(29(18)23)31917(30)24125613(21)14(22)712h18H923H2(H2430)(H2526)
MFCD07211290
O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1N)c1(nH)nc(c1)c1ccc(cc1)Cl
O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1N)c1n(nH)c(c1)c1ccc(cc1)Cl
ZINC000009487832
ZINC09487832
ZINC9487832

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Available files

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