Vitas-M small molecule compound
2-[(2-cyanophenyl)amino]-2-oxoethyl S-benzyl-N-(phenylcarbonyl)cysteinate
Catalog ID
STK510628
SMILES N#Cc1ccccc1NC(=O)COC(=O)C(NC(=O)c1ccccc1)CSCc1ccccc1
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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 C26H23N3O4S MW 473.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O4S/c27-15-21-13-7-8-14-22(21)28-24(30)16-33-26(32)23(18-34-17-19-9-3-1-4-10-19)29-25(31)20-11-5-2-6-12-20/h1-14,23H,16-18H2,(H,28,30)(H,29,31)InChIKey
BWHBZFYKCTVPFY-UHFFFAOYSA-NSynonyms
(2(2CYANOANILINO)2OXOETHYL)2BENZAMIDO3BENZYLSULFANYLPROPANOATE
2((2cyanophenyl)amino)2oxoethylSbenzylN(phenylcarbonyl)cysteinate
C1=CC=C(C=C1)CSCC(C(=O)OCC(=O)NC2=CC=CC=C2C#N)NC(=O)C3=CC=CC=C3
InChI=1SC26H23N3O4Sc27152113781422(21)2824(30)163326(32)23(1834171993141019)2925(31)20115261220h11423H1618H2(H2830)(H2931)
MFCD06013458
ZINC000012376570
ZINC000012376571
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