Vitas-M small molecule compound
2-{[6-methyl-3-(2-methylpropyl)-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[4-(propan-2-yl)benzyl]acetamide
Catalog ID
STL111559
SMILES CC(Cn1c(SCC(=O)NCc2ccc(cc2)C(C)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 C23H30N4O2S MW 426.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N4O2S/c1-14(2)12-27-22(29)21-19(10-16(5)25-21)26-23(27)30-13-20(28)24-11-17-6-8-18(9-7-17)15(3)4/h6-10,14-15,25H,11-13H2,1-5H3,(H,24,28)InChIKey
WJSZDQOLYHKEPI-UHFFFAOYSA-NSynonyms
2((6methyl3(2methylpropyl)4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(4(propan2yl)benzyl)acetamide
2((6methyl3(2methylpropyl)4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N((4propan2ylphenyl)methyl)acetamide
CC(Cn1c(SCC(=O)NCc2ccc(cc2)C(C)C)nc2c(c1=O)(nH)c(c2)C)C
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NCC3=CC=C(C=C3)C(C)C)CC(C)C
InChI=1SC23H30N4O2Sc114(2)122722(29)2119(1016(5)2521)2623(27)301320(28)2411176818(9717)15(3)4h610141525H1113H215H3(H2428)
MFCD20746440
ZINC000067319743
ZINC67319743
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