Vitas-M small molecule compound
2-{4-methoxy-3-[(4-methoxyphenoxy)methyl]phenyl}-9-(thiophen-2-yl)-7-(trifluoromethyl)-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
Catalog ID
STK434166
SMILES COc1ccc(cc1COc1ccc(cc1)OC)C1NC(=O)c2c(N1)c1c(s2)nc(cc1c1cccs1)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 C29H22F3N3O4S2 MW 597.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22F3N3O4S2/c1-37-17-6-8-18(9-7-17)39-14-16-12-15(5-10-20(16)38-2)26-34-24-23-19(21-4-3-11-40-21)13-22(29(30,31)32)33-28(23)41-25(24)27(36)35-26/h3-13,26,34H,14H2,1-2H3,(H,35,36)InChIKey
PRVWGSSZDRZHQJ-UHFFFAOYSA-NSynonyms
2(4methoxy3((4methoxyphenoxy)methyl)phenyl)9(thiophen2yl)7(trifluoromethyl)23dihydropyrido(3245)thieno(32d)pyrimidin4(1H)one
2(4methoxy3((4methoxyphenoxy)methyl)phenyl)9thiophen2yl7(trifluoromethyl)23dihydro1Hpyrido(23)thieno(24d)pyrimidin4one
COC1=CC=C(C=C1)OCC2=C(C=CC(=C2)C3NC4=C(C(=O)N3)SC5=C4C(=CC(=N5)C(F)(F)F)C6=CC=CS6)OC
InChI=1SC29H22F3N3O4S2c137176818(9717)3914161215(51020(16)382)2634242319(2143114021)1322(29(3031)32)3328(23)4125(24)27(36)3526h3132634H14H212H3(H3536)
MFCD03942627
ZINC000006296656
ZINC000006304022
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