Vitas-M small molecule compound
N-(butan-2-yl)-2-[(3-ethyl-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STL084382
SMILES CCC(NC(=O)CSc1nc2cc([nH]c2c(=O)n1CC)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 C15H22N4O2S MW 322.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22N4O2S/c1-5-9(3)16-12(20)8-22-15-18-11-7-10(4)17-13(11)14(21)19(15)6-2/h7,9,17H,5-6,8H2,1-4H3,(H,16,20)InChIKey
CLODCTWKJOMRGQ-UHFFFAOYSA-NSynonyms
CCC(C)NC(=O)CSC1=NC2=C(C(=O)N1CC)NC(=C2)C
CCC(NC(=O)CSc1nc2cc((nH)c2c(=O)n1CC)C)C
InChI=1SC15H22N4O2Sc159(3)1612(20)822151811710(4)1713(11)14(21)19(15)62h7917H568H214H3(H1620)
MFCD18202952
N(butan2yl)2((3ethyl6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
Nbutan2yl2((3ethyl6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000057521759
ZINC000057521766
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