Vitas-M small molecule compound
(2E)-2-cyano-3-[(2-methylbenzyl)sulfanyl]-N-(2-methylphenyl)-3-(phenylamino)prop-2-enamide
Catalog ID
STL133906
SMILES N#C/C(=C(/Nc1ccccc1)\SCc1ccccc1C)/C(=O)Nc1ccccc1C
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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 C25H23N3OS MW 413.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3OS/c1-18-10-6-8-12-20(18)17-30-25(27-21-13-4-3-5-14-21)22(16-26)24(29)28-23-15-9-7-11-19(23)2/h3-15,27H,17H2,1-2H3,(H,28,29)/b25-22+InChIKey
SYKFVHBUWYUMEK-YYDJUVGSSA-NSynonyms
(2E)2cyano3((2methylbenzyl)sulfanyl)N(2methylphenyl)3(phenylamino)prop2enamide
(E)3anilino2cyanoN(2methylphenyl)3((2methylphenyl)methylsulfanyl)prop2enamide
CC1=CC=CC=C1CSC(=C(C#N)C(=O)NC2=CC=CC=C2C)NC3=CC=CC=C3
InChI=1SC25H23N3OSc11810681220(18)173025(2721134351421)22(1626)24(29)282315971119(23)2h31527H17H212H3(H2829)b2522+
MFCD02935371
N#CC(=C(Nc1ccccc1)SCc1ccccc1C)C(=O)Nc1ccccc1C
ZINC000003058762
ZINC3058762
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