Vitas-M small molecule compound
(5Z)-1-(4-chlorophenyl)-5-[3-methoxy-4-(3-phenoxypropoxy)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK056365
SMILES COc1cc(ccc1OCCCOc1ccccc1)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl
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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 C27H23ClN2O6 MW 506.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23ClN2O6/c1-34-24-17-18(8-13-23(24)36-15-5-14-35-21-6-3-2-4-7-21)16-22-25(31)29-27(33)30(26(22)32)20-11-9-19(28)10-12-20/h2-4,6-13,16-17H,5,14-15H2,1H3,(H,29,31,33)/b22-16-InChIKey
ACLZFKVMQPCGJU-JWGURIENSA-NSynonyms
728930-75-4(5Z)1(4chlorophenyl)5((3methoxy4(3phenoxypropoxy)phenyl)methylidene)13diazinane246trione
(5Z)1(4CHLOROPHENYL)5(3METHOXY4(3PHENOXYPROPOXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
728930754
COC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Cl)OCCCOC4=CC=CC=C4
COc1cc(ccc1OCCCOc1ccccc1)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl
InChI=1SC27H23ClN2O6c134241718(81323(24)361551435216324721)162225(31)2927(33)30(26(22)32)2011919(28)101220h246131617H51415H21H3(H293133)b2216
MFCD05975956
STK056365
ZINC000009514049
ZINC09514049
ZINC9514049
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