Vitas-M small molecule compound
methyl 5-cyano-6-({2-[(2,4-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STL381281
SMILES COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1)OC)C#N)SCC(=O)Nc1ccc(cc1Cl)Cl
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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 C23H19Cl2N3O5S MW 520.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19Cl2N3O5S/c1-32-14-6-3-12(4-7-14)19-15(10-26)22(28-21(30)20(19)23(31)33-2)34-11-18(29)27-17-8-5-13(24)9-16(17)25/h3-9,19-20H,11H2,1-2H3,(H,27,29)(H,28,30)InChIKey
JVIFCNGCVDIMNK-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)C2C(C(=O)NC(=C2C#N)SCC(=O)NC3=C(C=C(C=C3)Cl)Cl)C(=O)OC
InChI=1SC23H19Cl2N3O5Sc132146312(4714)1915(1026)22(2821(30)20(19)23(31)332)341118(29)27178513(24)916(17)25h391920H11H212H3(H2729)(H2830)
methyl5cyano6((2((24dichlorophenyl)amino)2oxoethyl)sulfanyl)4(4methoxyphenyl)2oxo1234tetrahydropyridine3carboxylate
METHYL5CYANO6(2(24DICHLOROANILINO)2OXOETHYL)SULFANYL4(4METHOXYPHENYL)2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
MFCD04151839
ZINC000000639122
ZINC000000639129
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