Vitas-M small molecule compound
4-[(E)-(2-{(2Z)-3-[4-(dimethylamino)phenyl]-2-[(phenylcarbonyl)amino]prop-2-enoyl}hydrazinylidene)methyl]-2-ethoxyphenyl thiophene-2-carboxylate
Catalog ID
STK513932
SMILES CCOc1cc(/C=N/NC(=O)/C(=C/c2ccc(cc2)N(C)C)/NC(=O)c2ccccc2)ccc1OC(=O)c1cccs1
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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 C32H30N4O5S MW 582.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N4O5S/c1-4-40-28-20-23(14-17-27(28)41-32(39)29-11-8-18-42-29)21-33-35-31(38)26(34-30(37)24-9-6-5-7-10-24)19-22-12-15-25(16-13-22)36(2)3/h5-21H,4H2,1-3H3,(H,34,37)(H,35,38)/b26-19-,33-21+InChIKey
WVMHRRKAMWETCZ-DMWWXTJWSA-NSynonyms
(4((E)(((Z)2benzamido3(4(dimethylamino)phenyl)prop2enoyl)hydrazinylidene)methyl)2ethoxyphenyl)thiophene2carboxylate
4((E)(2((2Z)3(4(dimethylamino)phenyl)2((phenylcarbonyl)amino)prop2enoyl)hydrazinylidene)methyl)2ethoxyphenylthiophene2carboxylate
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=CS4
CCOc1cc(C=NNC(=O)C(=Cc2ccc(cc2)N(C)C)NC(=O)c2ccccc2)ccc1OC(=O)c1cccs1
InChI=1SC32H30N4O5Sc1440282023(141727(28)4132(39)29118184229)21333531(38)26(3430(37)2496571024)1922121525(161322)36(2)3h521H4H213H3(H3437)(H3538)b26193321+
MFCD13370525
ZINC000097964233
ZINC102277869
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