Vitas-M small molecule compound
N-benzyl-2-[(3-ethyl-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STL084361
SMILES CCn1c(SCC(=O)NCc2ccccc2)nc2c(c1=O)[nH]c(c2)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 C18H20N4O2S MW 356.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O2S/c1-3-22-17(24)16-14(9-12(2)20-16)21-18(22)25-11-15(23)19-10-13-7-5-4-6-8-13/h4-9,20H,3,10-11H2,1-2H3,(H,19,23)InChIKey
QCKVMQWFVQKNBT-UHFFFAOYSA-NSynonyms
CCN1C(=O)C2=C(C=C(N2)C)N=C1SCC(=O)NCC3=CC=CC=C3
CCn1c(SCC(=O)NCc2ccccc2)nc2c(c1=O)(nH)c(c2)C
InChI=1SC18H20N4O2Sc132217(24)1614(912(2)2016)2118(22)251115(23)1910137546813h4920H31011H212H3(H1923)
MFCD18202931
Nbenzyl2((3ethyl6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
Nbenzyl2((3ethyl6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000057521685
ZINC57521685
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