Vitas-M small molecule compound

2-cyanoethyl 6-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK077931
SMILES N#CCCOC(=O)C1=C(C)NC(=O)NC1c1cccc(c1)Oc1ccccc1

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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 C21H19N3O4 MW 377.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O4/c1-14-18(20(25)27-12-6-11-22)19(24-21(26)23-14)15-7-5-10-17(13-15)28-16-8-3-2-4-9-16/h2-5,7-10,13,19H,6,12H2,1H3,(H2,23,24,26)
InChIKey
ZICPYIGNFGQQGJ-UHFFFAOYSA-N
Synonyms

2CYANOETHYL4METHYL2OXO6(3PHENOXYPHENYL)136TRIHYDROPYRIMIDINE5CARBOXYLATE
2cyanoethyl6methyl2oxo4(3phenoxyphenyl)1234tetrahydropyrimidine5carboxylate
2CYANOETHYL6METHYL2OXO4(3PHENOXYPHENYL)34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CC1=C(C(NC(=O)N1)C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)OCCC#N
InChI=1SC21H19N3O4c11418(20(25)271261122)19(2421(26)2314)15751017(1315)28168324916h257101319H612H21H3(H2232426)
MFCD01192490
N#CCCOC(=O)C1=C(C)NC(=O)NC1c1cccc(c1)Oc1ccccc1
STK077931
ZINC000004189351
ZINC000004189352

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Available files

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