Vitas-M small molecule compound
4-(3-chlorophenyl)-1-[(4-fluorobenzyl)sulfanyl]-7,7-dimethyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK556710
SMILES Fc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)Cl)CC(OC3)(C)C
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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 C25H20ClFN4O2S2 MW 527.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClFN4O2S2/c1-25(2)11-18-19(12-33-25)35-22-20(18)21(32)30(17-5-3-4-15(26)10-17)23-28-29-24(31(22)23)34-13-14-6-8-16(27)9-7-14/h3-10H,11-13H2,1-2H3InChIKey
XUXBDIHMGIWPOJ-UHFFFAOYSA-NSynonyms
573933-46-74(3chlorophenyl)1((4fluorobenzyl)sulfanyl)77dimethyl69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4(3chlorophenyl)1((4fluorobenzyl)thio)77dimethyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
573933467
CC1(CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC5=CC=C(C=C5)F)C6=CC(=CC=C6)Cl)C
InChI=1SC25H20ClFN4O2S2c125(2)111819(123325)352220(18)21(32)30(1753415(26)1017)23282924(31(22)23)3413146816(27)9714h310H1113H212H3
MFCD04019826
ZINC000002195541
ZINC2195541
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