Vitas-M small molecule compound
N-(7-tert-butyl-2-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Catalog ID
STK304022
SMILES O=C(c1ccc(o1)Cn1nc(c(c1C)[N+](=O)[O-])C)Nn1c(C)nc2c(c1=O)c1CCC(Cc1s2)C(C)(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 C26H30N6O5S MW 538.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N6O5S/c1-13-22(32(35)36)14(2)30(28-13)12-17-8-10-19(37-17)23(33)29-31-15(3)27-24-21(25(31)34)18-9-7-16(26(4,5)6)11-20(18)38-24/h8,10,16H,7,9,11-12H2,1-6H3,(H,29,33)InChIKey
JQVMMSBHJORADH-UHFFFAOYSA-NSynonyms
1005560-64-41005560644
CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NN3C(=NC4=C(C3=O)C5=C(S4)CC(CC5)C(C)(C)C)C)C)(N+)(=O)(O)
InChI=1SC26H30N6O5Sc11322(32(35)36)14(2)30(2813)121781019(3717)23(33)293115(3)272421(25(31)34)189716(26(45)6)1120(18)3824h81016H791112H216H3(H2933)
MFCD04044159
N(7tertbutyl2methyl4oxo5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)5((35dimethyl4nitro1Hpyrazol1yl)methyl)furan2carboxamide
N(7tertbutyl2methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)5((35dimethyl4nitropyrazol1yl)methyl)furan2carboxamide
O=C(c1ccc(o1)Cn1nc(c(c1C)(N+)(=O)(O))C)Nn1c(C)nc2c(c1=O)c1CCC(Cc1s2)C(C)(C)C
ZINC000002779133
ZINC000002779134
Check stock
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Check stock on Vitas-MAvailable files
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