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-(3-methylphenyl)benzenesulfonamide
Catalog ID
STK955604
SMILES CCOc1ccc(cc1c1nc2c(c(=O)[nH]1)n(nc2C(C)(C)C)C)S(=O)(=O)Nc1cccc(c1)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 C25H29N5O4S MW 495.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O4S/c1-7-34-19-12-11-17(35(32,33)29-16-10-8-9-15(2)13-16)14-18(19)23-26-20-21(24(31)27-23)30(6)28-22(20)25(3,4)5/h8-14,29H,7H2,1-6H3,(H,26,27,31)InChIKey
IKWMOPPPZVJYKN-UHFFFAOYSA-NSynonyms
3(3(tertbutyl)1methyl7oxo67dihydro1Hpyrazolo(43d)pyrimidin5yl)4ethoxyN(mtolyl)benzenesulfonamide
3(3TERTBUTYL1METHYL7OXO4HPYRAZOLO(43D)PYRIMIDIN5YL)4ETHOXYN(3METHYLPHENYL)BENZENESULFONAMIDE
3(3tertbutyl1methyl7oxo67dihydro1Hpyrazolo(43d)pyrimidin5yl)4ethoxyN(3methylphenyl)benzenesulfonamide
CCOC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C)C3=NC(=O)C4=C(N3)C(=NN4C)C(C)(C)C
CCOc1ccc(cc1c1nc2c(c(=O)(nH)1)n(nc2C(C)(C)C)C)S(=O)(=O)Nc1cccc(c1)C
InChI=1SC25H29N5O4Sc173419121117(35(3233)2916108915(2)1316)1418(19)23262021(24(31)2723)30(6)2822(20)25(34)5h81429H7H216H3(H262731)
MFCD02161956
ZINC000002290370
ZINC02290370
ZINC2290370
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