Vitas-M small molecule compound
N-cyclohexyl-N-methyl-2-{[6-methyl-3-(3-methylbutyl)-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL093601
SMILES CC(CCn1c(SCC(=O)N(C2CCCCC2)C)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 C21H32N4O2S MW 404.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H32N4O2S/c1-14(2)10-11-25-20(27)19-17(12-15(3)22-19)23-21(25)28-13-18(26)24(4)16-8-6-5-7-9-16/h12,14,16,22H,5-11,13H2,1-4H3InChIKey
PPXVHAOBACCMAP-UHFFFAOYSA-NSynonyms
CC(CCn1c(SCC(=O)N(C2CCCCC2)C)nc2c(c1=O)(nH)c(c2)C)C
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)N(C)C3CCCCC3)CCC(C)C
InChI=1SC21H32N4O2Sc114(2)10112520(27)1917(1215(3)2219)2321(25)281318(26)24(4)168657916h12141622H51113H214H3
MFCD18787735
NcyclohexylNmethyl2((6methyl3(3methylbutyl)4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
NcyclohexylNmethyl2((6methyl3(3methylbutyl)4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067238087
ZINC67238087
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