Vitas-M small molecule compound
5-cyano-6-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-4-(2-fluorophenyl)-N-(2-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK887335
SMILES CCN(C(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1OC)c1ccccc1F)CC
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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 C27H29FN4O3S MW 508.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29FN4O3S/c1-5-32(6-2)23(33)16-36-27-19(15-29)25(18-11-7-8-12-20(18)28)24(17(3)30-27)26(34)31-21-13-9-10-14-22(21)35-4/h7-14,25,30H,5-6,16H2,1-4H3,(H,31,34)InChIKey
PLCGUQRSSDBAJQ-UHFFFAOYSA-NSynonyms
442557-86-0442557860
5cyano6((2(diethylamino)2oxoethyl)sulfanyl)4(2fluorophenyl)N(2methoxyphenyl)2methyl14dihydropyridine3carboxamide
5CYANO6((2(DIETHYLAMINO)2OXOETHYL)THIO)4(2FLUOROPHENYL)N(2METHOXYPHENYL)2METHYL14DIHYDROPYRIDINE3CARBOXAMIDE
5CYANO6(2(DIETHYLAMINO)2OXOETHYL)SULFANYL4(2FLUOROPHENYL)N(2METHOXYPHENYL)2METHYL14DIHYDROPYRIDINE3CARBOXAMIDE
CCN(CC)C(=O)CSC1=C(C(C(=C(N1)C)C(=O)NC2=CC=CC=C2OC)C3=CC=CC=C3F)C#N
InChI=1SC27H29FN4O3Sc1532(62)23(33)16362719(1529)25(1811781220(18)28)24(17(3)3027)26(34)3121139101422(21)354h7142530H5616H214H3(H3134)
MFCD04425887
ZINC000020348673
ZINC000020348675
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