Vitas-M small molecule compound
1-(3-nitrophenyl)-2-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Catalog ID
STK818878
SMILES CC(c1nnc(s1)N1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)cccc1)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 C22H16N4O5S MW 448.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4O5S/c1-11(2)20-23-24-22(32-20)25-17(12-6-5-7-13(10-12)26(29)30)16-18(27)14-8-3-4-9-15(14)31-19(16)21(25)28/h3-11,17H,1-2H3InChIKey
WMEYHKJCGAXQRH-UHFFFAOYSA-NSynonyms
620589-26-61(3nitrophenyl)2(5(propan2yl)134thiadiazol2yl)12dihydrochromeno(23c)pyrrole39dione
1(3NITROPHENYL)2(5PROPAN2YL134THIADIAZOL2YL)1HCHROMENO(23C)PYRROLE39DIONE
620589266
CC(C)C1=NN=C(S1)N2C(C3=C(C2=O)OC4=CC=CC=C4C3=O)C5=CC(=CC=C5)(N+)(=O)(O)
CC(c1nnc(s1)N1C(=O)c2c(C1c1cccc(c1)(N+)(=O)(O))c(=O)c1c(o2)cccc1)C
InChI=1SC22H16N4O5Sc111(2)20232422(3220)2517(1265713(1012)26(29)30)1618(27)14834915(14)3119(16)21(25)28h31117H12H3
MFCD04448097
ZINC000001131386
ZINC000001131388
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