Vitas-M small molecule compound
4-ethoxy-3-(1-methyl-7-oxo-3-propyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(2-nitrophenyl)benzenesulfonamide
Catalog ID
STL327275
SMILES CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)Nc1ccccc1[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 C23H24N6O6S MW 512.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N6O6S/c1-4-8-17-20-21(28(3)26-17)23(30)25-22(24-20)15-13-14(11-12-19(15)35-5-2)36(33,34)27-16-9-6-7-10-18(16)29(31)32/h6-7,9-13,27H,4-5,8H2,1-3H3,(H,24,25,30)InChIKey
LLAVQJDMDSTZGW-UHFFFAOYSA-NSynonyms
372493-58-8372493588
4ETHOXY3(1METHYL7OXO3PROPYL4HPYRAZOLO(43D)PYRIMIDIN5YL)N(2NITROPHENYL)BENZENESULFONAMIDE
4ethoxy3(1methyl7oxo3propyl67dihydro1Hpyrazolo(43d)pyrimidin5yl)N(2nitrophenyl)benzenesulfonamide
CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)NC4=CC=CC=C4(N+)(=O)(O))OCC)C
CCCc1nn(c2c1nc((nH)c2=O)c1cc(ccc1OCC)S(=O)(=O)Nc1ccccc1(N+)(=O)(O))C
InChI=1SC23H24N6O6Sc148172021(28(3)2617)23(30)2522(2420)151314(111219(15)3552)36(3334)27169671018(16)29(31)32h6791327H458H213H3(H242530)
MFCD01942548
ZINC000009144986
ZINC9144986
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