Vitas-M small molecule compound
(5E)-5-[(4-chlorophenyl){[2-(1H-indol-3-yl)ethyl]amino}methylidene]-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL440963
SMILES COc1ccc(cc1)N1C(=O)NC(=O)/C(=C(/c2ccc(cc2)Cl)\NCCc2c[nH]c3c2cccc3)/C1=O
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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 C28H23ClN4O4 MW 514.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23ClN4O4/c1-37-21-12-10-20(11-13-21)33-27(35)24(26(34)32-28(33)36)25(17-6-8-19(29)9-7-17)30-15-14-18-16-31-23-5-3-2-4-22(18)23/h2-13,16,30-31H,14-15H2,1H3,(H,32,34,36)/b25-24+InChIKey
IPDBFRVRFCGKAI-OCOZRVBESA-NSynonyms
(5E)5((4chlorophenyl)((2(1Hindol3yl)ethyl)amino)methylidene)1(4methoxyphenyl)pyrimidine246(1H3H5H)trione
(5E)5((4CHLOROPHENYL)(2(1HINDOL3YL)ETHYLAMINO)METHYLIDENE)1(4METHOXYPHENYL)13DIAZINANE246TRIONE
COC1=CC=C(C=C1)N2C(=O)C(=C(C3=CC=C(C=C3)Cl)NCCC4=CNC5=CC=CC=C54)C(=O)NC2=O
COc1ccc(cc1)N1C(=O)NC(=O)C(=C(c2ccc(cc2)Cl)NCCc2c(nH)c3c2cccc3)C1=O
InChI=1SC28H23ClN4O4c13721121020(111321)3327(35)24(26(34)3228(33)36)25(176819(29)9717)30151418163123532422(18)23h213163031H1415H21H3(H323436)b2524+
MFCD06241050
ZINC000025182135
ZINC25182135
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