Vitas-M small molecule compound
N-(2,6-dimethylphenyl)-2-{[6-methyl-3-(2-methylpropyl)-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL103840
SMILES CC(Cn1c(SCC(=O)Nc2c(C)cccc2C)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 C21H26N4O2S MW 398.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O2S/c1-12(2)10-25-20(27)19-16(9-15(5)22-19)23-21(25)28-11-17(26)24-18-13(3)7-6-8-14(18)4/h6-9,12,22H,10-11H2,1-5H3,(H,24,26)InChIKey
VCNCDJJHZXEMGR-UHFFFAOYSA-NSynonyms
CC(Cn1c(SCC(=O)Nc2c(C)cccc2C)nc2c(c1=O)(nH)c(c2)C)C
CC1=C(C(=CC=C1)C)NC(=O)CSC2=NC3=C(C(=O)N2CC(C)C)NC(=C3)C
InChI=1SC21H26N4O2Sc112(2)102520(27)1916(915(5)2219)2321(25)281117(26)241813(3)76814(18)4h691222H1011H215H3(H2426)
MFCD20735442
N(26dimethylphenyl)2((6methyl3(2methylpropyl)4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(26dimethylphenyl)2((6methyl3(2methylpropyl)4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067237721
ZINC67237721
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