Vitas-M small molecule compound
2-[(E)-(2-{(2E)-3-(1,3-benzodioxol-5-yl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}hydrazinylidene)methyl]-4,6-dibromophenyl 1,3-benzodioxole-5-carboxylate
Catalog ID
STK672001
SMILES Brc1cc(/C=N/NC(=O)/C(=C\c2ccc3c(c2)OCO3)/NC(=O)c2ccccc2)c(c(c1)Br)OC(=O)c1ccc2c(c1)OCO2
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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 C32H21Br2N3O8 MW 735.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H21Br2N3O8/c33-22-12-21(29(23(34)14-22)45-32(40)20-7-9-26-28(13-20)44-17-42-26)15-35-37-31(39)24(36-30(38)19-4-2-1-3-5-19)10-18-6-8-25-27(11-18)43-16-41-25/h1-15H,16-17H2,(H,36,38)(H,37,39)/b24-10+,35-15+InChIKey
WAVACAJKJPHJNN-XVIZTCEISA-NSynonyms
(2((E)(((E)2benzamido3(13benzodioxol5yl)prop2enoyl)hydrazinylidene)methyl)46dibromophenyl)13benzodioxole5carboxylate
2((E)(2((2E)3(13BENZODIOXOL5YL)2((PHENYLCARBONYL)AMINO)PROP2ENOYL)HYDRAZINYLIDENE)METHYL)46DIBROMOPHENYL13BENZODIOXOLE5CARBOXYLATE
Brc1cc(C=NNC(=O)C(=Cc2ccc3c(c2)OCO3)NC(=O)c2ccccc2)c(c(c1)Br)OC(=O)c1ccc2c(c1)OCO2
C1OC2=C(O1)C=C(C=C2)C=C(C(=O)NN=CC3=CC(=CC(=C3OC(=O)C4=CC5=C(C=C4)OCO5)Br)Br)NC(=O)C6=CC=CC=C6
InChI=1SC32H21Br2N3O8c33221221(29(23(34)1422)4532(40)20792628(1320)44174226)15353731(39)24(3630(38)194213519)1018682527(1118)43164125h115H1617H2(H3638)(H3739)b2410+3515+
MFCD00822113
ZINC000150352686
ZINC150599498
Check stock
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Check stock on Vitas-MAvailable files
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