Vitas-M small molecule compound
ethyl {[7,7-dimethyl-5-oxo-4-(2-phenylethyl)-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetate
Catalog ID
STL334078
SMILES CCOC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)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 C24H26N4O4S2 MW 498.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O4S2/c1-4-31-18(29)14-33-23-26-25-22-27(11-10-15-8-6-5-7-9-15)20(30)19-16-12-24(2,3)32-13-17(16)34-21(19)28(22)23/h5-9H,4,10-14H2,1-3H3InChIKey
FVHKBCGQVYJESF-UHFFFAOYSA-NSynonyms
488794-23-6488794236
CCOC(=O)CSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)(C)C)C(=O)N2CCC5=CC=CC=C5
ethyl((77dimethyl5oxo4(2phenylethyl)4569tetrahydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)acetate
ethyl2((77dimethyl5oxo4phenethyl5679tetrahydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)acetate
InChI=1SC24H26N4O4S2c143118(29)14332326252227(1110158657915)20(30)19161224(23)321317(16)3421(19)28(22)23h59H41014H213H3
MFCD03192512
ZINC000002341918
ZINC02341918
ZINC2341918
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