Vitas-M small molecule compound
N-(4-chloro-2,5-dimethoxyphenyl)-2-methyl-4-(3-nitrophenyl)-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide
Catalog ID
STK665395
SMILES COc1cc(Cl)c(cc1NC(=O)C1=C(C)Nc2n(C1c1cccc(c1)[N+](=O)[O-])c1ccccc1n2)OC
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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 C26H22ClN5O5 MW 519.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN5O5/c1-14-23(25(33)29-19-13-21(36-2)17(27)12-22(19)37-3)24(15-7-6-8-16(11-15)32(34)35)31-20-10-5-4-9-18(20)30-26(31)28-14/h4-13,24H,1-3H3,(H,28,30)(H,29,33)InChIKey
XORNXCZFKTUTLB-UHFFFAOYSA-NSynonyms
CC1=C(C(N2C3=CC=CC=C3N=C2N1)C4=CC(=CC=C4)(N+)(=O)(O))C(=O)NC5=CC(=C(C=C5OC)Cl)OC
COc1cc(Cl)c(cc1NC(=O)C1=C(C)Nc2n(C1c1cccc(c1)(N+)(=O)(O))c1ccccc1n2)OC
InChI=1SC26H22ClN5O5c11423(25(33)29191321(362)17(27)1222(19)373)24(1576816(1115)32(34)35)31201054918(20)3026(31)2814h41324H13H3(H2830)(H2933)
MFCD06668070
N(4CHLORO25DIMETHOXYPHENYL)(2METHYL4(3NITROPHENYL)(145TRIHYDROPYRIMIDINO(12A)BENZIMIDAZOL3YL))CARBOXAMIDE
N(4chloro25dimethoxyphenyl)2methyl4(3nitrophenyl)14dihydropyrimido(12a)benzimidazole3carboxamide
ZINC000001069378
ZINC000001069383
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