Vitas-M small molecule compound
N-(4-phenylbutan-2-yl)-2-[(4,7,7-trimethyl-5-oxo-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]acetamide
Catalog ID
STK551522
SMILES CC(NC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2C)CC(OC3)(C)C)CCc1ccccc1
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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 C25H29N5O3S2 MW 511.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O3S2/c1-15(10-11-16-8-6-5-7-9-16)26-19(31)14-34-24-28-27-23-29(4)21(32)20-17-12-25(2,3)33-13-18(17)35-22(20)30(23)24/h5-9,15H,10-14H2,1-4H3,(H,26,31)InChIKey
QZIUOQXAVIQRFP-UHFFFAOYSA-NSynonyms
799806-42-1799806421
CC(CCC1=CC=CC=C1)NC(=O)CSC2=NN=C3N2C4=C(C5=C(S4)COC(C5)(C)C)C(=O)N3C
InChI=1SC25H29N5O3S2c115(1011168657916)2619(31)14342428272329(4)21(32)20171225(23)331318(17)3522(20)30(23)24h5915H1014H214H3(H2631)
MFCD03679151
N(4phenylbutan2yl)2((477trimethyl5oxo4569tetrahydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)acetamide
N(4phenylbutan2yl)2((477trimethyl5oxo5679tetrahydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)acetamide
ZINC000002225382
ZINC000002225383
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