Vitas-M small molecule compound
3-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)propanamide
Catalog ID
STK307233
SMILES O=C(Nn1c(S)nc2c(c1=O)cccc2)CCn1nc(cc1C)C(F)(F)F
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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 C16H14F3N5O2S MW 397.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14F3N5O2S/c1-9-8-12(16(17,18)19)21-23(9)7-6-13(25)22-24-14(26)10-4-2-3-5-11(10)20-15(24)27/h2-5,8H,6-7H2,1H3,(H,20,27)(H,22,25)InChIKey
BKCLRQIZEHUGDN-UHFFFAOYSA-NSynonyms
1005652-44-71005652447
3(5methyl3(trifluoromethyl)1Hpyrazol1yl)N(4oxo2sulfanylquinazolin3(4H)yl)propanamide
3(5METHYL3(TRIFLUOROMETHYL)PYRAZOL1YL)N(4OXO2SULFANYLIDENE1HQUINAZOLIN3YL)PROPANAMIDE
CC1=CC(=NN1CCC(=O)NN2C(=O)C3=CC=CC=C3NC2=S)C(F)(F)F
InChI=1SC16H14F3N5O2Sc19812(16(1718)19)2123(9)7613(25)222414(26)10423511(10)2015(24)27h258H67H21H3(H2027)(H2225)
MFCD04130571
ZINC000102005128
ZINC102005128
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