Vitas-M small molecule compound
(5Z)-1-(4-chlorophenyl)-5-[3-methoxy-4-(propan-2-yloxy)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK031380
SMILES COc1cc(ccc1OC(C)C)/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 C21H19ClN2O5 MW 414.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O5/c1-12(2)29-17-9-4-13(11-18(17)28-3)10-16-19(25)23-21(27)24(20(16)26)15-7-5-14(22)6-8-15/h4-12H,1-3H3,(H,23,25,27)/b16-10-InChIKey
ZBMIOHAZFWKBFQ-YBEGLDIGSA-NSynonyms
(5Z)1(4CHLOROPHENYL)5((3METHOXY4PROPAN2YLOXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(4CHLOROPHENYL)5(3METHOXY4(PROPAN2YLOXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CC(C)OC1=C(C=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Cl)OC
COc1cc(ccc1OC(C)C)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl
InChI=1SC21H19ClN2O5c112(2)29179413(1118(17)283)101619(25)2321(27)24(20(16)26)157514(22)6815h412H13H3(H232527)b1610
MFCD05976026
STK031380
ZINC000004603758
ZINC04603758
ZINC4603758
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