Vitas-M small molecule compound
2-{[3-(furan-2-ylmethyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Catalog ID
STL088421
SMILES O=C(Nc1cccc(c1)C(F)(F)F)CSc1nc2ccccc2c(=O)n1Cc1ccco1
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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 C22H16F3N3O3S MW 459.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16F3N3O3S/c23-22(24,25)14-5-3-6-15(11-14)26-19(29)13-32-21-27-18-9-2-1-8-17(18)20(30)28(21)12-16-7-4-10-31-16/h1-11H,12-13H2,(H,26,29)InChIKey
HHNXYCOIOCXNRI-UHFFFAOYSA-NSynonyms
2((3(furan2ylmethyl)4oxo34dihydroquinazolin2yl)sulfanyl)N(3(trifluoromethyl)phenyl)acetamide
2(3(2FURYLMETHYL)4OXO(3HYDROQUINAZOLIN2YLTHIO))N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2(3(FURAN2YLMETHYL)4OXOQUINAZOLIN2YL)SULFANYLN(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F)CC4=CC=CO4
InChI=1SC22H16F3N3O3Sc2322(2425)1453615(1114)2619(29)1332212718921817(18)20(30)28(21)121674103116h111H1213H2(H2629)
MFCD02651157
ZINC000002970188
ZINC02970188
ZINC2970188
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