Vitas-M small molecule compound
5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-(2-methyl-4-oxo-6-propylthieno[2,3-d]pyrimidin-3(4H)-yl)furan-2-carboxamide
Catalog ID
STL393234
SMILES CCCc1sc2c(c1)c(=O)n(c(n2)C)NC(=O)c1ccc(o1)Cn1nc(c(c1C)[N+](=O)[O-])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 C21H22N6O5S MW 470.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O5S/c1-5-6-15-9-16-20(33-15)22-13(4)26(21(16)29)24-19(28)17-8-7-14(32-17)10-25-12(3)18(27(30)31)11(2)23-25/h7-9H,5-6,10H2,1-4H3,(H,24,28)InChIKey
OEEWIADSBUKBKN-UHFFFAOYSA-NSynonyms
1005628-93-21005628932
5((35DIMETHYL4NITRO1HPYRAZOL1YL)METHYL)N(2METHYL4OXO6PROPYLTHIENO(23D)PYRIMIDIN3(4H)YL)FURAN2CARBOXAMIDE
5((35dimethyl4nitropyrazol1yl)methyl)N(2methyl4oxo6propylthieno(23d)pyrimidin3yl)furan2carboxamide
CCCC1=CC2=C(S1)N=C(N(C2=O)NC(=O)C3=CC=C(O3)CN4C(=C(C(=N4)C)(N+)(=O)(O))C)C
CCCc1sc2c(c1)c(=O)n(c(n2)C)NC(=O)c1ccc(o1)Cn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC21H22N6O5Sc1561591620(3315)2213(4)26(21(16)29)2419(28)178714(3217)102512(3)18(27(30)31)11(2)2325h79H5610H214H3(H2428)
MFCD04044161
ZINC000002780842
ZINC02780842
ZINC2780842
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