Vitas-M small molecule compound
prop-2-en-1-yl 5-cyano-2-methyl-6-{[2-(naphthalen-1-ylamino)-2-oxoethyl]sulfanyl}-4-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK886023
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccccc1)C#N)SCC(=O)Nc1cccc2c1cccc2
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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 C29H25N3O3S MW 495.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O3S/c1-3-16-35-29(34)26-19(2)31-28(23(17-30)27(26)21-11-5-4-6-12-21)36-18-25(33)32-24-15-9-13-20-10-7-8-14-22(20)24/h3-15,27,31H,1,16,18H2,2H3,(H,32,33)InChIKey
GFQAGOOENLPPMP-UHFFFAOYSA-NSynonyms
796879-58-8796879588
allyl5cyano2methyl6((2(naphthalen1ylamino)2oxoethyl)thio)4phenyl14dihydropyridine3carboxylate
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=CC3=CC=CC=C32)C#N)C4=CC=CC=C4)C(=O)OCC=C
InChI=1SC29H25N3O3Sc13163529(34)2619(2)3128(23(1730)27(26)21115461221)361825(33)3224159132010781422(20)24h3152731H11618H22H3(H3233)
MFCD03669952
prop2en1yl5cyano2methyl6((2(naphthalen1ylamino)2oxoethyl)sulfanyl)4phenyl14dihydropyridine3carboxylate
PROP2ENYL5CYANO2METHYL6(2(NAPHTHALEN1YLAMINO)2OXOETHYL)SULFANYL4PHENYL14DIHYDROPYRIDINE3CARBOXYLATE
ZINC000020150274
ZINC000020150275
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