Vitas-M small molecule compound
propan-2-yl 2-ethyl-4-hydroxythieno[3'',2'':5',6']pyrimido[1',2':1,5]pyrrolo[2,3-b]quinoxaline-6-carboxylate
Catalog ID
STK635615
SMILES CCc1cc2c(s1)n1c3nc4ccccc4nc3c(c1nc2O)C(=O)OC(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 C21H18N4O3S MW 406.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O3S/c1-4-11-9-12-19(26)24-17-15(21(27)28-10(2)3)16-18(25(17)20(12)29-11)23-14-8-6-5-7-13(14)22-16/h5-10H,4H2,1-3H3,(H,24,26)InChIKey
NYDJNPZJTUTOPG-UHFFFAOYSA-NSynonyms
797764-93-3797764933
CCC1=CC2=C(S1)N3C(=C(C4=NC5=CC=CC=C5N=C43)C(=O)OC(C)C)NC2=O
InChI=1SC21H18N4O3Sc141191219(26)241715(21(27)2810(2)3)1618(25(17)20(12)2911)2314865713(14)2216h510H4H213H3(H2426)
MFCD18160791
propan2yl2ethyl4hydroxythieno(3256)pyrimido(1215)pyrrolo(23b)quinoxaline6carboxylate
ZINC000005695226
ZINC5695226
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