Vitas-M small molecule compound

ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-[(4-nitrophenyl)amino]pyrimidine-5-carboxylate

Catalog ID
STL041244
SMILES CCOC(=O)c1cnc(nc1Nc1ccc(cc1)[N+](=O)[O-])n1nc(cc1C)C

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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 C18H18N6O4 MW 382.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O4/c1-4-28-17(25)15-10-19-18(23-12(3)9-11(2)22-23)21-16(15)20-13-5-7-14(8-6-13)24(26)27/h5-10H,4H2,1-3H3,(H,19,20,21)
InChIKey
SJLZXCMPMJFLNP-UHFFFAOYSA-N
Synonyms
1004019-21-9
1004019219
CCOC(=O)C1=CN=C(N=C1NC2=CC=C(C=C2)(N+)(=O)(O))N3C(=CC(=N3)C)C
CCOC(=O)c1cnc(nc1Nc1ccc(cc1)(N+)(=O)(O))n1nc(cc1C)C
ethyl2(35dimethyl1Hpyrazol1yl)4((4nitrophenyl)amino)pyrimidine5carboxylate
ETHYL2(35DIMETHYLPYRAZOL1YL)4(4NITROANILINO)PYRIMIDINE5CARBOXYLATE
InChI=1SC18H18N6O4c142817(25)15101918(2312(3)911(2)2223)2116(15)20135714(8613)24(26)27h510H4H213H3(H192021)
MFCD04014836
ZINC000005029073
ZINC05029073
ZINC5029073

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Available files

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