Vitas-M small molecule compound
N-butyl-2-{[3-(3,4-dimethylphenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-methylacetamide
Catalog ID
STL031390
SMILES CCCCN(C(=O)CSc1nc2ccsc2c(=O)n1c1ccc(c(c1)C)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 C21H25N3O2S2 MW 415.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O2S2/c1-5-6-10-23(4)18(25)13-28-21-22-17-9-11-27-19(17)20(26)24(21)16-8-7-14(2)15(3)12-16/h7-9,11-12H,5-6,10,13H2,1-4H3InChIKey
PXMGKHCSBPHELS-UHFFFAOYSA-NSynonyms
CCCCN(C)C(=O)CSC1=NC2=C(C(=O)N1C3=CC(=C(C=C3)C)C)SC=C2
InChI=1SC21H25N3O2S2c1561023(4)18(25)13282122179112719(17)20(26)24(21)168714(2)15(3)1216h791112H561013H214H3
MFCD18191436
Nbutyl2((3(34dimethylphenyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)Nmethylacetamide
Nbutyl2(3(34dimethylphenyl)4oxothieno(32d)pyrimidin2yl)sulfanylNmethylacetamide
ZINC000057428482
ZINC57428482
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