Vitas-M small molecule compound
3-tert-butyl-5-[2-ethoxy-5-(morpholin-4-ylsulfonyl)phenyl]-1-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Catalog ID
STK536675
SMILES CCOc1ccc(cc1c1nc2c(c(=O)[nH]1)n(nc2C(C)(C)C)C)S(=O)(=O)N1CCOCC1
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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 C22H29N5O5S MW 475.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N5O5S/c1-6-32-16-8-7-14(33(29,30)27-9-11-31-12-10-27)13-15(16)20-23-17-18(21(28)24-20)26(5)25-19(17)22(2,3)4/h7-8,13H,6,9-12H2,1-5H3,(H,23,24,28)InChIKey
NTTWJNPWHHKVSS-UHFFFAOYSA-NSynonyms
3(tertbutyl)5(2ethoxy5(morpholinosulfonyl)phenyl)1methyl1Hpyrazolo(43d)pyrimidin7(6H)one
3tertbutyl5(2ethoxy5(morpholin4ylsulfonyl)phenyl)1methyl16dihydro7Hpyrazolo(43d)pyrimidin7one
3TERTBUTYL5(2ETHOXY5MORPHOLIN4YLSULFONYLPHENYL)1METHYL4HPYRAZOLO(43D)PYRIMIDIN7ONE
CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)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)N1CCOCC1
InChI=1SC22H29N5O5Sc1632168714(33(2930)2791131121027)1315(16)20231718(21(28)2420)26(5)2519(17)22(23)4h7813H6912H215H3(H232428)
MFCD02162131
ZINC000009731377
ZINC09731377
ZINC9731377
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