Vitas-M small molecule compound
tert-butyl {4-[(E)-(2-{[(3,4-dichlorophenyl)(phenylsulfonyl)amino]acetyl}hydrazinylidene)methyl]phenoxy}acetate (non-preferred name)
Catalog ID
STK360875
SMILES O=C(CN(S(=O)(=O)c1ccccc1)c1ccc(c(c1)Cl)Cl)N/N=C/c1ccc(cc1)OCC(=O)OC(C)(C)C
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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 C27H27Cl2N3O6S MW 592.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27Cl2N3O6S/c1-27(2,3)38-26(34)18-37-21-12-9-19(10-13-21)16-30-31-25(33)17-32(20-11-14-23(28)24(29)15-20)39(35,36)22-7-5-4-6-8-22/h4-16H,17-18H2,1-3H3,(H,31,33)/b30-16+InChIKey
KSNLEOMZXIBUIF-OKCVXOCRSA-NSynonyms
CC(C)(C)OC(=O)COC1=CC=C(C=C1)C=NNC(=O)CN(C2=CC(=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=CC=C3
InChI=1SC27H27Cl2N3O6Sc127(23)3826(34)18372112919(101321)16303125(33)1732(20111423(28)24(29)1520)39(3536)227546822h416H1718H213H3(H3133)b3016+
MFCD03175764
O=C(CN(S(=O)(=O)c1ccccc1)c1ccc(c(c1)Cl)Cl)NN=Cc1ccc(cc1)OCC(=O)OC(C)(C)C
tertbutyl(4((E)(2(((34dichlorophenyl)(phenylsulfonyl)amino)acetyl)hydrazinylidene)methyl)phenoxy)acetate(nonpreferredname)
tertbutyl2(4((E)((2(N(benzenesulfonyl)34dichloroanilino)acetyl)hydrazinylidene)methyl)phenoxy)acetate
ZINC000097962788
ZINC101949206
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