Vitas-M small molecule compound
4-[(E)-(2-{(2Z)-3-[4-(dimethylamino)phenyl]-2-[(phenylcarbonyl)amino]prop-2-enoyl}hydrazinylidene)methyl]-2-ethoxyphenyl 4-nitrobenzoate
Catalog ID
STK499205
SMILES CCOc1cc(/C=N/NC(=O)/C(=C/c2ccc(cc2)N(C)C)/NC(=O)c2ccccc2)ccc1OC(=O)c1ccc(cc1)[N+](=O)[O-]
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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 C34H31N5O7 MW 621.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H31N5O7/c1-4-45-31-21-24(12-19-30(31)46-34(42)26-13-17-28(18-14-26)39(43)44)22-35-37-33(41)29(36-32(40)25-8-6-5-7-9-25)20-23-10-15-27(16-11-23)38(2)3/h5-22H,4H2,1-3H3,(H,36,40)(H,37,41)/b29-20-,35-22+InChIKey
JYLPSBVDGVNAIO-CTZKLECSSA-NSynonyms
(4((E)(((Z)2benzamido3(4(dimethylamino)phenyl)prop2enoyl)hydrazinylidene)methyl)2ethoxyphenyl)4nitrobenzoate
4((E)(2((2Z)3(4(dimethylamino)phenyl)2((phenylcarbonyl)amino)prop2enoyl)hydrazinylidene)methyl)2ethoxyphenyl4nitrobenzoate
CCOC1=C(C=CC(=C1)C=NNC(=O)C(=CC2=CC=C(C=C2)N(C)C)NC(=O)C3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
CCOc1cc(C=NNC(=O)C(=Cc2ccc(cc2)N(C)C)NC(=O)c2ccccc2)ccc1OC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC34H31N5O7c1445312124(121930(31)4634(42)26131728(181426)39(43)44)22353733(41)29(3632(40)258657925)2023101527(161123)38(2)3h522H4H213H3(H3640)(H3741)b29203522+
MFCD11855638
ZINC000059192787
ZINC102277374
Check stock
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Check stock on Vitas-MAvailable files
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