Vitas-M small molecule compound
ethyl 4-(2-chlorophenyl)-6-({2-[(3-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK885998
SMILES CCOC(=O)C1=C(NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1cccc(c1)Cl)c1ccccc1
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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 C29H23Cl2N3O3S MW 564.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23Cl2N3O3S/c1-2-37-29(36)26-25(21-13-6-7-14-23(21)31)22(16-32)28(34-27(26)18-9-4-3-5-10-18)38-17-24(35)33-20-12-8-11-19(30)15-20/h3-15,25,34H,2,17H2,1H3,(H,33,35)InChIKey
QYIHSUXTNXOXHJ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C#N)SCC(=O)NC3=CC(=CC=C3)Cl)C4=CC=CC=C4
ethyl4(2chlorophenyl)6((2((3chlorophenyl)amino)2oxoethyl)sulfanyl)5cyano2phenyl14dihydropyridine3carboxylate
ethyl6(2(3chloroanilino)2oxoethyl)sulfanyl4(2chlorophenyl)5cyano2phenyl14dihydropyridine3carboxylate
InChI=1SC29H23Cl2N3O3Sc123729(36)2625(2113671423(21)31)22(1632)28(3427(26)1894351018)381724(35)33201281119(30)1520h3152534H217H21H3(H3335)
MFCD10086534
ZINC000101304906
ZINC000101304915
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