Vitas-M small molecule compound

(5Z)-5-(3-ethoxy-4-{2-[2-(4-methylphenoxy)ethoxy]ethoxy}benzylidene)-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK044704
SMILES CCOc1cc(ccc1OCCOCCOc1ccc(cc1)C)/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)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 C31H32N2O7 MW 544.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N2O7/c1-4-38-28-20-23(10-13-27(28)40-17-15-37-14-16-39-25-11-8-21(2)9-12-25)19-26-29(34)32-31(36)33(30(26)35)24-7-5-6-22(3)18-24/h5-13,18-20H,4,14-17H2,1-3H3,(H,32,34,36)/b26-19-
InChIKey
JGZLKACJDKQVEL-XHPQRKPJSA-N
Synonyms

(5Z)5((3ethoxy4(2(2(4methylphenoxy)ethoxy)ethoxy)phenyl)methylidene)1(3methylphenyl)13diazinane246trione
(5Z)5(3ETHOXY4(2(2(4METHYLPHENOXY)ETHOXY)ETHOXY)BENZYLIDENE)1(3METHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
5((3ETHOXY4(2(2(4METHYLPHENOXY)ETHOXY)ETHOXY)PHENYL)METHYLENE)1(3METHYLPHENYL)13DIHYDROPYRIMIDINE246TRIONE
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=CC(=C3)C)OCCOCCOC4=CC=C(C=C4)C
CCOc1cc(ccc1OCCOCCOc1ccc(cc1)C)C=C1C(=O)NC(=O)N(C1=O)c1cccc(c1)C
InChI=1SC31H32N2O7c1438282023(101327(28)401715371416392511821(2)91225)192629(34)3231(36)33(30(26)35)2475622(3)1824h5131820H41417H213H3(H323436)b2619
MFCD01873587
STK044704
ZINC000100229347
ZINC100229347

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Available files

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