Vitas-M small molecule compound
methyl 4-(4-ethylpiperazin-1-yl)-3-({[3-nitro-4-(pyrrolidin-1-yl)phenyl]carbonyl}amino)benzoate
Catalog ID
STK189106
SMILES CCN1CCN(CC1)c1ccc(cc1NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCCC1)C(=O)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 C25H31N5O5 MW 481.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N5O5/c1-3-27-12-14-29(15-13-27)21-8-7-19(25(32)35-2)16-20(21)26-24(31)18-6-9-22(23(17-18)30(33)34)28-10-4-5-11-28/h6-9,16-17H,3-5,10-15H2,1-2H3,(H,26,31)InChIKey
ZLSJQBXWKVPQKH-UHFFFAOYSA-NSynonyms
CCN1CCN(CC1)c1ccc(cc1NC(=O)c1ccc(c(c1)(N+)(=O)(O))N1CCCC1)C(=O)OC
CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC(=C(C=C3)N4CCCC4)(N+)(=O)(O)
InChI=1SC25H31N5O5c1327121429(151327)218719(25(32)352)1620(21)2624(31)186922(23(1718)30(33)34)2810451128h691617H351015H212H3(H2631)
METHYL4(4ETHYLPIPERAZIN1YL)3(((3NITRO4(PYRROLIDIN1YL)PHENYL)CARBONYL)AMINO)BENZOATE
methyl4(4ethylpiperazin1yl)3((3nitro4pyrrolidin1ylbenzoyl)amino)benzoate
MFCD06665192
ZINC000009908000
ZINC9908000
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