Vitas-M small molecule compound
5-cyano-4-(furan-2-yl)-2-methyl-N-(2-methylphenyl)-6-({2-[(4-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK826564
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)[N+](=O)[O-])NC(=C(C1c1ccco1)C(=O)Nc1ccccc1C)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 C27H23N5O5S MW 529.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N5O5S/c1-16-6-3-4-7-21(16)31-26(34)24-17(2)29-27(20(14-28)25(24)22-8-5-13-37-22)38-15-23(33)30-18-9-11-19(12-10-18)32(35)36/h3-13,25,29H,15H2,1-2H3,(H,30,33)(H,31,34)InChIKey
ABQXQPGGTUMFDW-UHFFFAOYSA-NSynonyms
5cyano4(furan2yl)2methylN(2methylphenyl)6((2((4nitrophenyl)amino)2oxoethyl)sulfanyl)14dihydropyridine3carboxamide
5cyano4(furan2yl)2methylN(2methylphenyl)6(2(4nitroanilino)2oxoethyl)sulfanyl14dihydropyridine3carboxamide
CC1=CC=CC=C1NC(=O)C2=C(NC(=C(C2C3=CC=CO3)C#N)SCC(=O)NC4=CC=C(C=C4)(N+)(=O)(O))C
InChI=1SC27H23N5O5Sc116634721(16)3126(34)2417(2)2927(20(1428)25(24)2285133722)381523(33)301891119(121018)32(35)36h3132529H15H212H3(H3033)(H3134)
MFCD03723881
N#CC1=C(SCC(=O)Nc2ccc(cc2)(N+)(=O)(O))NC(=C(C1c1ccco1)C(=O)Nc1ccccc1C)C
ZINC000102652176
ZINC000102652178
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