Vitas-M small molecule compound
6-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK886153
SMILES N#CC1=C(SCC(=O)NCc2ccccc2)NC(=C(C1c1ccc(c(c1)OC)O)C(=O)Nc1ccccc1)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 C30H28N4O4S MW 540.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N4O4S/c1-19-27(29(37)34-22-11-7-4-8-12-22)28(21-13-14-24(35)25(15-21)38-2)23(16-31)30(33-19)39-18-26(36)32-17-20-9-5-3-6-10-20/h3-15,28,33,35H,17-18H2,1-2H3,(H,32,36)(H,34,37)InChIKey
ZJRYXDUMUHZBBP-UHFFFAOYSA-NSynonyms
6((2(benzylamino)2oxoethyl)sulfanyl)5cyano4(4hydroxy3methoxyphenyl)2methylNphenyl14dihydropyridine3carboxamide
6(2(benzylamino)2oxoethyl)sulfanyl5cyano4(4hydroxy3methoxyphenyl)2methylNphenyl14dihydropyridine3carboxamide
CC1=C(C(C(=C(N1)SCC(=O)NCC2=CC=CC=C2)C#N)C3=CC(=C(C=C3)O)OC)C(=O)NC4=CC=CC=C4
InChI=1SC30H28N4O4Sc11927(29(37)3422117481222)28(21131424(35)25(1521)382)23(1631)30(3319)391826(36)32172095361020h315283335H1718H212H3(H3236)(H3437)
MFCD18172030
ZINC000102753500
ZINC000102753501
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