Vitas-M small molecule compound
prop-2-en-1-yl 6-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-5-cyano-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK887283
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)NCc1ccccc1
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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 C24H23N3O4S MW 449.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O4S/c1-3-11-31-24(29)21-16(2)27-23(18(13-25)22(21)19-10-7-12-30-19)32-15-20(28)26-14-17-8-5-4-6-9-17/h3-10,12,22,27H,1,11,14-15H2,2H3,(H,26,28)InChIKey
YQVRGZZRAQKLNS-UHFFFAOYSA-NSynonyms
CC1=C(C(C(=C(N1)SCC(=O)NCC2=CC=CC=C2)C#N)C3=CC=CO3)C(=O)OCC=C
InChI=1SC24H23N3O4Sc13113124(29)2116(2)2723(18(1325)22(21)19107123019)321520(28)2614178546917h310122227H1111415H22H3(H2628)
MFCD10088145
prop2en1yl6((2(benzylamino)2oxoethyl)sulfanyl)5cyano4(furan2yl)2methyl14dihydropyridine3carboxylate
prop2enyl6(2(benzylamino)2oxoethyl)sulfanyl5cyano4(furan2yl)2methyl14dihydropyridine3carboxylate
ZINC000020348560
ZINC000020348562
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