Vitas-M small molecule compound

N-(tetrahydrofuran-2-ylmethyl)-2-{[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl}acetamide

Catalog ID
STK339002
SMILES O=C(CSc1nc2c3ccccc3CCc2c(n1)C(F)(F)F)NCC1CCCO1

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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 C20H20F3N3O2S MW 423.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20F3N3O2S/c21-20(22,23)18-15-8-7-12-4-1-2-6-14(12)17(15)25-19(26-18)29-11-16(27)24-10-13-5-3-9-28-13/h1-2,4,6,13H,3,5,7-11H2,(H,24,27)
InChIKey
YKGUPEDKHDJWLB-UHFFFAOYSA-N
Synonyms
333784-79-5
333784795
C1CC(OC1)CNC(=O)CSC2=NC3=C(CCC4=CC=CC=C43)C(=N2)C(F)(F)F
InChI=1SC20H20F3N3O2Sc2120(2223)18158712412614(12)17(15)2519(2618)291116(27)2410135392813h124613H35711H2(H2427)
MFCD02572809
N(OXOLAN2YLMETHYL)2((4(TRIFLUOROMETHYL)56DIHYDROBENZO(H)QUINAZOLIN2YL)SULFANYL)ACETAMIDE
N(OXOLAN2YLMETHYL)2(4(TRIFLUOROMETHYL)(56DIHYDROBENZO(H)QUINAZOLIN2YLTHIO))ACETAMIDE
N(TETRAHYDRO2FURANYLMETHYL)2((4(TRIFLUOROMETHYL)56DIHYDROBENZO(H)QUINAZOLIN2YL)SULFANYL)ACETAMIDE
N(tetrahydrofuran2ylmethyl)2((4(trifluoromethyl)56dihydrobenzo(h)quinazolin2yl)sulfanyl)acetamide
ZINC000000885350
ZINC000000885352

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.