Vitas-M small molecule compound
(5Z)-1-(2,3-dimethylphenyl)-5-({1-[2-(morpholin-4-yl)-2-oxoethyl]-1H-indol-3-yl}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK170830
SMILES O=C(N1CCOCC1)Cn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1C)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 C27H26N4O5 MW 486.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O5/c1-17-6-5-9-22(18(17)2)31-26(34)21(25(33)28-27(31)35)14-19-15-30(23-8-4-3-7-20(19)23)16-24(32)29-10-12-36-13-11-29/h3-9,14-15H,10-13,16H2,1-2H3,(H,28,33,35)/b21-14-InChIKey
PNVYNOHONQXMIZ-STZFKDTASA-NSynonyms
(5Z)1(23DIMETHYLPHENYL)5((1(2(MORPHOLIN4YL)2OXOETHYL)1HINDOL3YL)METHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
(5Z)1(23dimethylphenyl)5((1(2morpholin4yl2oxoethyl)indol3yl)methylidene)13diazinane246trione
CC1=C(C(=CC=C1)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC(=O)N5CCOCC5)C(=O)NC2=O)C
InChI=1SC27H26N4O5c11765922(18(17)2)3126(34)21(25(33)2827(31)35)14191530(23843720(19)23)1624(32)29101236131129h391415H101316H212H3(H283335)b2114
MFCD03240069
O=C(N1CCOCC1)Cn1cc(c2c1cccc2)C=C1C(=O)NC(=O)N(C1=O)c1cccc(c1C)C
ZINC000009891815
ZINC09891815
ZINC9891815
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