Vitas-M small molecule compound
(5Z)-1-(3-chlorophenyl)-5-{(phenylamino)[(3,4,5-trimethoxybenzyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL440550
SMILES COc1c(OC)cc(cc1OC)CN/C(=C/1\C(=O)NC(=O)N(C1=O)c1cccc(c1)Cl)/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 C27H25ClN4O6 MW 536.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25ClN4O6/c1-36-20-12-16(13-21(37-2)23(20)38-3)15-29-24(30-18-9-5-4-6-10-18)22-25(33)31-27(35)32(26(22)34)19-11-7-8-17(28)14-19/h4-14,29-30H,15H2,1-3H3,(H,31,33,35)/b24-22-InChIKey
JMPDKQCYJVOBLO-GYHWCHFESA-NSynonyms
(5Z)1(3chlorophenyl)5((phenylamino)((345trimethoxybenzyl)amino)methylidene)pyrimidine246(1H3H5H)trione
(5Z)5(anilino((345trimethoxyphenyl)methylamino)methylidene)1(3chlorophenyl)13diazinane246trione
COC1=CC(=CC(=C1OC)OC)CNC(=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC=C3)Cl)NC4=CC=CC=C4
COc1c(OC)cc(cc1OC)CNC(=C1C(=O)NC(=O)N(C1=O)c1cccc(c1)Cl)Nc1ccccc1
InChI=1SC27H25ClN4O6c136201216(1321(372)23(20)383)152924(301895461018)2225(33)3127(35)32(26(22)34)19117817(28)1419h4142930H15H213H3(H313335)b2422
MFCD06243677
ZINC000008757463
ZINC8757463
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