Vitas-M small molecule compound
3-(3-tert-butyl-1-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-ethoxy-N,N-dimethylbenzenesulfonamide
Catalog ID
STK838777
SMILES CCOc1ccc(cc1c1nc2c(c(=O)[nH]1)n(nc2C(C)(C)C)C)S(=O)(=O)N(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 C20H27N5O4S MW 433.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N5O4S/c1-8-29-14-10-9-12(30(27,28)24(5)6)11-13(14)18-21-15-16(19(26)22-18)25(7)23-17(15)20(2,3)4/h9-11H,8H2,1-7H3,(H,21,22,26)InChIKey
NSJUUISLFUSLML-UHFFFAOYSA-NSynonyms
3(3(tertbutyl)1methyl7oxo67dihydro1Hpyrazolo(43d)pyrimidin5yl)4ethoxyNNdimethylbenzenesulfonamide
3(3TERTBUTYL1METHYL7OXO4HPYRAZOLO(43D)PYRIMIDIN5YL)4ETHOXYNNDIMETHYLBENZENESULFONAMIDE
3(3tertbutyl1methyl7oxo67dihydro1Hpyrazolo(43d)pyrimidin5yl)4ethoxyNNdimethylbenzenesulfonamide
CCOC1=C(C=C(C=C1)S(=O)(=O)N(C)C)C2=NC(=O)C3=C(N2)C(=NN3C)C(C)(C)C
CCOc1ccc(cc1c1nc2c(c(=O)(nH)1)n(nc2C(C)(C)C)C)S(=O)(=O)N(C)C
InChI=1SC20H27N5O4Sc18291410912(30(2728)24(5)6)1113(14)18211516(19(26)2218)25(7)2317(15)20(23)4h911H8H217H3(H212226)
MFCD02163400
ZINC000018062313
ZINC18062313
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