Vitas-M small molecule compound

2-{4-[(E)-(2-{[(2,3-dimethylphenyl)(phenylsulfonyl)amino]acetyl}hydrazinylidene)methyl]phenoxy}-N-(1-phenylethyl)acetamide (non-preferred name)

Catalog ID
STL026393
SMILES O=C(NC(c1ccccc1)C)COc1ccc(cc1)/C=N/NC(=O)CN(S(=O)(=O)c1ccccc1)c1cccc(c1C)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 C33H34N4O5S MW 598.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H34N4O5S/c1-24-11-10-16-31(25(24)2)37(43(40,41)30-14-8-5-9-15-30)22-32(38)36-34-21-27-17-19-29(20-18-27)42-23-33(39)35-26(3)28-12-6-4-7-13-28/h4-21,26H,22-23H2,1-3H3,(H,35,39)(H,36,38)/b34-21+
InChIKey
XMMFFHUGJIKUDB-KEIPNQJHSA-N
Synonyms

2(4((E)(2(((23dimethylphenyl)(phenylsulfonyl)amino)acetyl)hydrazinylidene)methyl)phenoxy)N(1phenylethyl)acetamide(nonpreferredname)
2(4(2((23DIMETHYL(PHENYLSULFONYL)ANILINO)ACETYL)CARBOHYDRAZONOYL)PHENOXY)N(1PHENYLETHYL)ACETAMIDE
2(N(benzenesulfonyl)23dimethylanilino)N((E)(4(2oxo2(1phenylethylamino)ethoxy)phenyl)methylideneamino)acetamide
CC1=C(C(=CC=C1)N(CC(=O)NN=CC2=CC=C(C=C2)OCC(=O)NC(C)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)C
InChI=1SC33H34N4O5Sc12411101631(25(24)2)37(43(4041)30148591530)2232(38)36342127171929(201827)422333(39)3526(3)28126471328h42126H2223H213H3(H3539)(H3638)b3421+
MFCD03068753
O=C(NC(c1ccccc1)C)COc1ccc(cc1)C=NNC(=O)CN(S(=O)(=O)c1ccccc1)c1cccc(c1C)C
ZINC000008384593
ZINC000008384594

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.