Vitas-M small molecule compound
4-[(E)-(2-{(2E)-2-{[(2-chlorophenyl)carbonyl]amino}-3-[4-(dimethylamino)phenyl]prop-2-enoyl}hydrazinylidene)methyl]-2-methoxyphenyl 4-nitrobenzoate
Catalog ID
STK375149
SMILES COc1cc(/C=N/NC(=O)/C(=C\c2ccc(cc2)N(C)C)/NC(=O)c2ccccc2Cl)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 C33H28ClN5O7 MW 642.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H28ClN5O7/c1-38(2)24-13-8-21(9-14-24)18-28(36-31(40)26-6-4-5-7-27(26)34)32(41)37-35-20-22-10-17-29(30(19-22)45-3)46-33(42)23-11-15-25(16-12-23)39(43)44/h4-20H,1-3H3,(H,36,40)(H,37,41)/b28-18+,35-20+InChIKey
UFSSOVYOWKPYQS-FFYYKRJWSA-NSynonyms
(4((E)(((E)2((2chlorobenzoyl)amino)3(4(dimethylamino)phenyl)prop2enoyl)hydrazinylidene)methyl)2methoxyphenyl)4nitrobenzoate
4((1E)2((2E)3(4(DIMETHYLAMINO)PHENYL)2((2CHLOROPHENYL)CARBONYLAMINO)PROP2ENOYLAMINO)2AZAVINYL)2METHOXYPHENYL4NITROBENZOATE
4((E)(2((2E)2(((2chlorophenyl)carbonyl)amino)3(4(dimethylamino)phenyl)prop2enoyl)hydrazinylidene)methyl)2methoxyphenyl4nitrobenzoate
CN(C)C1=CC=C(C=C1)C=C(C(=O)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)(N+)(=O)(O))OC)NC(=O)C4=CC=CC=C4Cl
COc1cc(C=NNC(=O)C(=Cc2ccc(cc2)N(C)C)NC(=O)c2ccccc2Cl)ccc1OC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC33H28ClN5O7c138(2)2413821(91424)1828(3631(40)26645727(26)34)32(41)37352022101729(30(1922)453)4633(42)23111525(161223)39(43)44h420H13H3(H3640)(H3741)b2818+3520+
MFCD01129504
ZINC000004045448
ZINC150624989
Check stock
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Check stock on Vitas-MAvailable files
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