Vitas-M small molecule compound

(5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-6-hydroxy-3-(3-methylphenyl)pyrimidine-2,4(3H,5H)-dione

Catalog ID
STK578331
SMILES Cc1cccc(c1)N1C(=O)N=C(/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)/C1=O)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 C28H25N3O3 MW 451.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O3/c1-19-7-5-11-23(15-19)31-27(33)24(26(32)29-28(31)34)17-21-12-13-25-22(16-21)10-6-14-30(25)18-20-8-3-2-4-9-20/h2-5,7-9,11-13,15-17H,6,10,14,18H2,1H3,(H,29,32,34)/b24-17+
InChIKey
SSMGYNZJSLEFLZ-JJIBRWJFSA-N
Synonyms
1164473-73-7
(5E)1(3METHYLPHENYL)5((1(PHENYLMETHYL)34DIHYDRO2HQUINOLIN6YL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)5((1benzyl1234tetrahydroquinolin6yl)methylidene)6hydroxy3(3methylphenyl)pyrimidine24(3H5H)dione
(5E)5((1BENZYL34DIHYDRO2HQUINOLIN6YL)METHYLENE)1(MTOLYL)BARBITURICACID
(5E)5((1BENZYL34DIHYDRO2HQUINOLIN6YL)METHYLIDENE)1(3METHYLPHENYL)13DIAZINANE246TRIONE
1164473737
CC1=CC(=CC=C1)N2C(=O)C(=CC3=CC4=C(C=C3)N(CCC4)CC5=CC=CC=C5)C(=O)NC2=O
Cc1cccc(c1)N1C(=O)N=C(C(=Cc2ccc3c(c2)CCCN3Cc2ccccc2)C1=O)O
InChI=1SC28H25N3O3c119751123(1519)3127(33)24(26(32)2928(31)34)172112132522(1621)1061430(25)18208324920h257911131517H6101418H21H3(H293234)b2417+
MFCD07206089
ZINC000009089864
ZINC9089864

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Available files

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