Vitas-M small molecule compound
prop-2-en-1-yl 5-(3-bromophenyl)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK981454
SMILES C=CCOC(=O)C1=C(C)Nc2c(C1c1cccc(c1)Br)c(=O)n(c(=O)n2C)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 C20H20BrN3O4 MW 446.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrN3O4/c1-5-9-28-19(26)14-11(2)22-17-16(18(25)24(4)20(27)23(17)3)15(14)12-7-6-8-13(21)10-12/h5-8,10,15,22H,1,9H2,2-4H3InChIKey
QXRCBTJNRHMFDZ-UHFFFAOYSA-NSynonyms
622360-28-5622360285
CC1=C(C(C2=C(N1)N(C(=O)N(C2=O)C)C)C3=CC(=CC=C3)Br)C(=O)OCC=C
InChI=1SC20H20BrN3O4c1592819(26)1411(2)221716(18(25)24(4)20(27)23(17)3)15(14)1276813(21)1012h58101522H19H224H3
MFCD05884849
prop2en1yl5(3bromophenyl)137trimethyl24dioxo123458hexahydropyrido(23d)pyrimidine6carboxylate
PROP2ENYL5(3BROMOPHENYL)137TRIMETHYL24DIOXO58DIHYDROPYRIDO(23D)PYRIMIDINE6CARBOXYLATE
ZINC000002706581
ZINC000009489366
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