Vitas-M small molecule compound
5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)furan-2-carboxamide
Catalog ID
STK304150
SMILES CC1CCc2c(C1)sc1c2c(=O)n(c(n1)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 C23H24N6O5S MW 496.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N6O5S/c1-11-5-7-16-18(9-11)35-22-19(16)23(31)28(14(4)24-22)26-21(30)17-8-6-15(34-17)10-27-13(3)20(29(32)33)12(2)25-27/h6,8,11H,5,7,9-10H2,1-4H3,(H,26,30)InChIKey
KIULQTOBNMRUMR-UHFFFAOYSA-NSynonyms
1005707-79-81005707798
5((35dimethyl4nitro1Hpyrazol1yl)methyl)N(27dimethyl4oxo5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)furan2carboxamide
5((35dimethyl4nitropyrazol1yl)methyl)N(27dimethyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)furan2carboxamide
CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)C)NC(=O)C4=CC=C(O4)CN5C(=C(C(=N5)C)(N+)(=O)(O))C
CC1CCc2c(C1)sc1c2c(=O)n(c(n1)C)NC(=O)c1ccc(o1)Cn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC23H24N6O5Sc111571618(911)352219(16)23(31)28(14(4)2422)2621(30)178615(3417)102713(3)20(29(32)33)12(2)2527h6811H57910H214H3(H2630)
MFCD04044755
ZINC000002780156
ZINC000002780157
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