Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-[(7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Catalog ID
STL144308
SMILES O=C(Nc1ccc2c(c1)OCO2)CSc1ncnc2c1[nH]cc2c1ccccc1
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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 C21H16N4O3S MW 404.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N4O3S/c26-18(25-14-6-7-16-17(8-14)28-12-27-16)10-29-21-20-19(23-11-24-21)15(9-22-20)13-4-2-1-3-5-13/h1-9,11,22H,10,12H2,(H,25,26)InChIKey
DEROUUUNSKGFGW-UHFFFAOYSA-NSynonyms
1251698-09-51251698095
C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC=NC4=C3NC=C4C5=CC=CC=C5
InChI=1SC21H16N4O3Sc2618(2514671617(814)28122716)1029212019(23112421)15(92220)134213513h191122H1012H2(H2526)
MFCD16635848
N(13benzodioxol5yl)2((7phenyl5Hpyrrolo(32d)pyrimidin4yl)sulfanyl)acetamide
N(BENZO(D)(13)DIOXOL5YL)2((7PHENYL5HPYRROLO(32D)PYRIMIDIN4YL)THIO)ACETAMIDE
N13BENZODIOXOL5YL2((7PHENYL5HPYRROLO(32D)PYRIMIDIN4YL)THIO)ACETAMIDE
O=C(Nc1ccc2c(c1)OCO2)CSc1ncnc2c1(nH)cc2c1ccccc1
ZINC000048988694
ZINC48988694
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