Vitas-M small molecule compound
ethyl 7-[(4-tert-butylphenyl)sulfonyl]-1-methyl-6-oxo-1,3,4,6-tetrahydro-2H-pyrido[1,2-a]pyrimidine-9-carboxylate
Catalog ID
STL185717
SMILES CCOC(=O)c1cc(c(=O)n2c1N(C)CCC2)S(=O)(=O)c1ccc(cc1)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 C22H28N2O5S MW 432.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O5S/c1-6-29-21(26)17-14-18(20(25)24-13-7-12-23(5)19(17)24)30(27,28)16-10-8-15(9-11-16)22(2,3)4/h8-11,14H,6-7,12-13H2,1-5H3InChIKey
AQCAOJRZZYJZFL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C2N(CCCN2C(=O)C(=C1)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)C
ethyl7((4tertbutylphenyl)sulfonyl)1methyl6oxo1346tetrahydro2Hpyrido(12a)pyrimidine9carboxylate
ethyl7(4tertbutylphenyl)sulfonyl1methyl6oxo34dihydro2Hpyrido(12a)pyrimidine9carboxylate
InChI=1SC22H28N2O5Sc162921(26)171418(20(25)241371223(5)19(17)24)30(2728)1610815(91116)22(23)4h81114H671213H215H3
MFCD22387562
ZINC000072329873
ZINC72329873
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