Vitas-M small molecule compound
3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-(2-methyl-4-oxo-6,7-dihydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(5H)-yl)propanamide
Catalog ID
STK303502
SMILES O=C(Nn1c(C)nc2c(c1=O)c1CCCc1s2)CCn1nc(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 C18H20N6O4S MW 416.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6O4S/c1-9-16(24(27)28)10(2)22(20-9)8-7-14(25)21-23-11(3)19-17-15(18(23)26)12-5-4-6-13(12)29-17/h4-8H2,1-3H3,(H,21,25)InChIKey
KORRQXOIAHGZCJ-UHFFFAOYSA-NSynonyms
1005703-46-71005703467
3(35dimethyl4nitro1Hpyrazol1yl)N(2methyl4oxo67dihydro4Hcyclopenta(45)thieno(23d)pyrimidin3(5H)yl)propanamide
3(35dimethyl4nitropyrazol1yl)N(3methyl1oxo78dihydro6Hcyclopenta(23)thieno(24d)pyrimidin2yl)propanamide
CC1=C(C(=NN1CCC(=O)NN2C(=NC3=C(C2=O)C4=C(S3)CCC4)C)C)(N+)(=O)(O)
InChI=1SC18H20N6O4Sc1916(24(27)28)10(2)22(209)8714(25)212311(3)191715(18(23)26)1254613(12)2917h48H213H3(H2125)
MFCD04044598
O=C(Nn1c(C)nc2c(c1=O)c1CCCc1s2)CCn1nc(c(c1C)(N+)(=O)(O))C
ZINC000002777546
ZINC02777546
ZINC2777546
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