Vitas-M small molecule compound
2-methoxyethyl 2-methyl-4-(2-nitrophenyl)-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Catalog ID
STK225075
SMILES COCCOC(=O)C1=C(C)Nc2n(C1c1ccccc1[N+](=O)[O-])c1ccccc1n2
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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 C21H20N4O5 MW 408.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O5/c1-13-18(20(26)30-12-11-29-2)19(14-7-3-5-9-16(14)25(27)28)24-17-10-6-4-8-15(17)23-21(24)22-13/h3-10,19H,11-12H2,1-2H3,(H,22,23)InChIKey
NSPSVPODBQLNMY-UHFFFAOYSA-NSynonyms
2METHOXYETHYL2METHYL4(2NITROPHENYL)145TRIHYDROPYRIMIDINO(12A)BENZIMIDAZOLE3CARBOXYLATE
2METHOXYETHYL2METHYL4(2NITROPHENYL)14DIHYDROPYRIMIDO(12A)BENZIMIDAZOLE3CARBOXYLATE
CC1=C(C(N2C3=CC=CC=C3N=C2N1)C4=CC=CC=C4(N+)(=O)(O))C(=O)OCCOC
COCCOC(=O)C1=C(C)Nc2n(C1c1ccccc1(N+)(=O)(O))c1ccccc1n2
InChI=1SC21H20N4O5c11318(20(26)301211292)19(14735916(14)25(27)28)24171064815(17)2321(24)2213h31019H1112H212H3(H2223)
MFCD08088615
ZINC000004742033
ZINC000004742034
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