Vitas-M small molecule compound
2-{[3-(butan-2-yl)-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(2-chloropyridin-3-yl)acetamide
Catalog ID
STL093846
SMILES CCC(n1c(SCC(=O)Nc2cccnc2Cl)nc2c(c1=O)[nH]c(c2)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 C18H20ClN5O2S MW 405.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClN5O2S/c1-4-11(3)24-17(26)15-13(8-10(2)21-15)23-18(24)27-9-14(25)22-12-6-5-7-20-16(12)19/h5-8,11,21H,4,9H2,1-3H3,(H,22,25)InChIKey
CFTLGDRGXSSWSL-UHFFFAOYSA-NSynonyms
2((3(butan2yl)6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(2chloropyridin3yl)acetamide
2((3butan2yl6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(2chloropyridin3yl)acetamide
CCC(C)N1C(=O)C2=C(C=C(N2)C)N=C1SCC(=O)NC3=C(N=CC=C3)Cl
CCC(n1c(SCC(=O)Nc2cccnc2Cl)nc2c(c1=O)(nH)c(c2)C)C
InChI=1SC18H20ClN5O2Sc1411(3)2417(26)1513(810(2)2115)2318(24)27914(25)22126572016(12)19h581121H49H213H3(H2225)
MFCD18787980
ZINC000067239270
ZINC000067239272
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