Vitas-M small molecule compound

(5Z)-1-(3-chloro-4-methoxyphenyl)-5-{[1-(3-methylbenzyl)-1H-indol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK550579
SMILES COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2cccc(c2)C)/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 C28H22ClN3O4 MW 499.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22ClN3O4/c1-17-6-5-7-18(12-17)15-31-16-19(21-8-3-4-9-24(21)31)13-22-26(33)30-28(35)32(27(22)34)20-10-11-25(36-2)23(29)14-20/h3-14,16H,15H2,1-2H3,(H,30,33,35)/b22-13-
InChIKey
UQWOGXKEDLOXPP-XKZIYDEJSA-N
Synonyms
799801-60-8
(5Z)1(3CHLORO4METHOXYPHENYL)5((1((3METHYLPHENYL)METHYL)INDOL3YL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(3chloro4methoxyphenyl)5((1(3methylbenzyl)1Hindol3yl)methylidene)pyrimidine246(1H3H5H)trione
(Z)1(3chloro4methoxyphenyl)5((1(3methylbenzyl)1Hindol3yl)methylene)pyrimidine246(1H3H5H)trione
799801608
CC1=CC(=CC=C1)CN2C=C(C3=CC=CC=C32)C=C4C(=O)NC(=O)N(C4=O)C5=CC(=C(C=C5)OC)Cl
COc1ccc(cc1Cl)N1C(=O)NC(=O)C(=Cc2cn(c3c2cccc3)Cc2cccc(c2)C)C1=O
InChI=1SC28H22ClN3O4c11765718(1217)15311619(21834924(21)31)132226(33)3028(35)32(27(22)34)20101125(362)23(29)1420h31416H15H212H3(H303335)b2213
MFCD03678631
ZINC000008741104
ZINC8741104

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Available files

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