Vitas-M small molecule compound
2-(5-ethyl-1,3,4-thiadiazol-2-yl)-7-methyl-1-(3-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Catalog ID
STL052742
SMILES CCc1nnc(s1)N1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)ccc(c1)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/c1-3-16-23-24-22(32-16)25-18(12-5-4-6-13(10-12)26(29)30)17-19(27)14-9-11(2)7-8-15(14)31-20(17)21(25)28/h4-10,18H,3H2,1-2H3InChIKey
UHQUGKWKSXBEGR-UHFFFAOYSA-NSynonyms
632314-23-92(5ethyl134thiadiazol2yl)7methyl1(3nitrophenyl)12dihydrochromeno(23c)pyrrole39dione
2(5ETHYL134THIADIAZOL2YL)7METHYL1(3NITROPHENYL)1HCHROMENO(23C)PYRROLE39DIONE
632314239
CCC1=NN=C(S1)N2C(C3=C(C2=O)OC4=C(C3=O)C=C(C=C4)C)C5=CC(=CC=C5)(N+)(=O)(O)
CCc1nnc(s1)N1C(=O)c2c(C1c1cccc(c1)(N+)(=O)(O))c(=O)c1c(o2)ccc(c1)C
InChI=1SC22H16N4O5Sc1316232422(3216)2518(1254613(1012)26(29)30)1719(27)14911(2)7815(14)3120(17)21(25)28h41018H3H212H3
MFCD04157978
ZINC000002404318
ZINC000002404319
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