Vitas-M small molecule compound
ethyl 4-(4-benzylpiperazin-1-yl)-3-{[(3-methyl-4-nitrophenyl)carbonyl]amino}benzoate
Catalog ID
STK889364
SMILES CCOC(=O)c1ccc(c(c1)NC(=O)c1ccc(c(c1)C)[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 C28H30N4O5 MW 502.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O5/c1-3-37-28(34)23-10-12-26(31-15-13-30(14-16-31)19-21-7-5-4-6-8-21)24(18-23)29-27(33)22-9-11-25(32(35)36)20(2)17-22/h4-12,17-18H,3,13-16,19H2,1-2H3,(H,29,33)InChIKey
FIURJQXHUINJHT-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)NC(=O)C4=CC(=C(C=C4)(N+)(=O)(O))C
CCOC(=O)c1ccc(c(c1)NC(=O)c1ccc(c(c1)C)(N+)(=O)(O))N1CCN(CC1)Cc1ccccc1
ethyl4(4benzylpiperazin1yl)3(((3methyl4nitrophenyl)carbonyl)amino)benzoate
ethyl4(4benzylpiperazin1yl)3((3methyl4nitrobenzoyl)amino)benzoate
InChI=1SC28H30N4O5c133728(34)23101226(31151330(141631)19217546821)24(1823)2927(33)2291125(32(35)36)20(2)1722h4121718H3131619H212H3(H2933)
MFCD07174801
ZINC000016687777
ZINC16687777
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