Vitas-M small molecule compound
3-[4-(4-hydroxyphenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]benzoic acid
Catalog ID
STK610936
SMILES Oc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)N(C2)c1cccc(c1)C(=O)O)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 C20H17N3O5 MW 379.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O5/c1-22-15-10-23(13-4-2-3-12(9-13)19(26)27)18(25)16(15)17(21-20(22)28)11-5-7-14(24)8-6-11/h2-9,17,24H,10H2,1H3,(H,21,28)(H,26,27)InChIKey
ZCNCVCXWNNACDM-UHFFFAOYSA-NSynonyms
921135-58-23(4(4hydroxyphenyl)1methyl25dioxo123457hexahydro6Hpyrrolo(34d)pyrimidin6yl)benzoicacid
3(4(4hydroxyphenyl)1methyl25dioxo34dihydro1Hpyrrolo(34d)pyrimidin6(2H5H7H)yl)benzoicacid
3(4(4hydroxyphenyl)1methyl25dioxo47dihydro3Hpyrrolo(34d)pyrimidin6yl)benzoicacid
921135582
CN1C2=C(C(NC1=O)C3=CC=C(C=C3)O)C(=O)N(C2)C4=CC=CC(=C4)C(=O)O
InChI=1SC20H17N3O5c122151023(1342312(913)19(26)27)18(25)16(15)17(2120(22)28)115714(24)8611h291724H10H21H3(H2128)(H2627)
MFCD08747659
ZINC000009306426
ZINC000009306427
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