Vitas-M small molecule compound
benzyl 6-[(2-amino-2-oxoethyl)sulfanyl]-4-(4-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK839518
SMILES N#CC1=C(SCC(=O)N)NC(=C(C1c1ccc(cc1)Cl)C(=O)OCc1ccccc1)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 C23H20ClN3O3S MW 453.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClN3O3S/c1-14-20(23(29)30-12-15-5-3-2-4-6-15)21(16-7-9-17(24)10-8-16)18(11-25)22(27-14)31-13-19(26)28/h2-10,21,27H,12-13H2,1H3,(H2,26,28)InChIKey
CBLAMWBQZQVZLZ-UHFFFAOYSA-NSynonyms
370846-35-8370846358
benzyl6((2amino2oxoethyl)sulfanyl)4(4chlorophenyl)5cyano2methyl14dihydropyridine3carboxylate
BENZYL6((2AMINO2OXOETHYL)THIO)4(4CHLOROPHENYL)5CYANO2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
BENZYL6(2AMINO2OXOETHYL)SULFANYL4(4CHLOROPHENYL)5CYANO2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
CC1=C(C(C(=C(N1)SCC(=O)N)C#N)C2=CC=C(C=C2)Cl)C(=O)OCC3=CC=CC=C3
InChI=1SC23H20ClN3O3Sc11420(23(29)3012155324615)21(167917(24)10816)18(1125)22(2714)311319(26)28h2102127H1213H21H3(H22628)
MFCD02999396
ZINC000001145024
ZINC000001145028
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