Vitas-M small molecule compound
methyl 4-(4-benzylpiperazin-1-yl)-3-{[(2-chloro-4-nitrophenyl)carbonyl]amino}benzoate
Catalog ID
STK195138
SMILES COC(=O)c1ccc(c(c1)NC(=O)c1ccc(cc1Cl)[N+](=O)[O-])N1CCN(CC1)Cc1ccccc1
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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 C26H25ClN4O5 MW 508.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN4O5/c1-36-26(33)19-7-10-24(30-13-11-29(12-14-30)17-18-5-3-2-4-6-18)23(15-19)28-25(32)21-9-8-20(31(34)35)16-22(21)27/h2-10,15-16H,11-14,17H2,1H3,(H,28,32)InChIKey
AWMOWQDCFPUXNR-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)NC(=O)C4=C(C=C(C=C4)(N+)(=O)(O))Cl
COC(=O)c1ccc(c(c1)NC(=O)c1ccc(cc1Cl)(N+)(=O)(O))N1CCN(CC1)Cc1ccccc1
InChI=1SC26H25ClN4O5c13626(33)1971024(30131129(121430)17185324618)23(1519)2825(32)219820(31(34)35)1622(21)27h2101516H111417H21H3(H2832)
METHYL4(4BENZYLPIPERAZIN1YL)3(((2CHLORO4NITROPHENYL)CARBONYL)AMINO)BENZOATE
methyl4(4benzylpiperazin1yl)3((2chloro4nitrobenzoyl)amino)benzoate
MFCD06665602
ZINC000057222671
ZINC57222671
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