Vitas-M small molecule compound
(5Z)-1-(4-methylphenyl)-5-{(phenylamino)[(3,4,5-trimethoxybenzyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL447883
SMILES COc1c(OC)cc(cc1OC)CN/C(=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)C)/Nc1ccccc1
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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 C28H28N4O6 MW 516.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O6/c1-17-10-12-20(13-11-17)32-27(34)23(26(33)31-28(32)35)25(30-19-8-6-5-7-9-19)29-16-18-14-21(36-2)24(38-4)22(15-18)37-3/h5-15,29-30H,16H2,1-4H3,(H,31,33,35)/b25-23-InChIKey
OFMFPOLIVUPMRK-BZZOAKBMSA-NSynonyms
(5Z)1(4methylphenyl)5((phenylamino)((345trimethoxybenzyl)amino)methylidene)pyrimidine246(1H3H5H)trione
(5Z)5(anilino((345trimethoxyphenyl)methylamino)methylidene)1(4methylphenyl)13diazinane246trione
CC1=CC=C(C=C1)N2C(=O)C(=C(NCC3=CC(=C(C(=C3)OC)OC)OC)NC4=CC=CC=C4)C(=O)NC2=O
COc1c(OC)cc(cc1OC)CNC(=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)C)Nc1ccccc1
InChI=1SC28H28N4O6c117101220(131117)3227(34)23(26(33)3128(32)35)25(30198657919)2916181421(362)24(384)22(1518)373h5152930H16H214H3(H313335)b2523
MFCD08273238
ZINC000008757634
ZINC8757634
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