Vitas-M small molecule compound
(5Z)-6-hydroxy-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)-3-(naphthalen-1-yl)pyrimidine-2,4(3H,5H)-dione
Catalog ID
STL046883
SMILES O=C1N=C(O)/C(=C/NCCCn2cncc2)/C(=O)N1c1cccc2c1cccc2
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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 C21H19N5O3 MW 389.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O3/c27-19-17(13-22-9-4-11-25-12-10-23-14-25)20(28)26(21(29)24-19)18-8-3-6-15-5-1-2-7-16(15)18/h1-3,5-8,10,12-14,22H,4,9,11H2,(H,24,27,29)/b17-13-InChIKey
HESSWMWQAKVCBM-LGMDPLHJSA-NSynonyms
(5Z)5((3imidazol1ylpropylamino)methylidene)1naphthalen1yl13diazinane246trione
(5Z)6hydroxy5(((3(1Himidazol1yl)propyl)amino)methylidene)3(naphthalen1yl)pyrimidine24(3H5H)dione
C1=CC=C2C(=C1)C=CC=C2N3C(=O)C(=CNCCCN4C=CN=C4)C(=O)NC3=O
InChI=1SC21H19N5O3c271917(13229411251210231425)20(28)26(21(29)2419)1883615512716(15)18h135810121422H4911H2(H242729)b1713
MFCD03794566
O=C1N=C(O)C(=CNCCCn2cncc2)C(=O)N1c1cccc2c1cccc2
ZINC000019997201
ZINC19997201
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