Vitas-M small molecule compound
2-[4-(1,3-benzodioxol-5-yl)-7,7-dimethyl-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Catalog ID
STK784497
SMILES N#Cc1c(sc2c1CCCCC2)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccc2c(c1)OCO2
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C28H28N2O4S MW 488.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O4S/c1-28(2)12-20-26(21(31)13-28)18(16-8-9-22-23(10-16)34-15-33-22)11-25(32)30(20)27-19(14-29)17-6-4-3-5-7-24(17)35-27/h8-10,18H,3-7,11-13,15H2,1-2H3InChIKey
MQDGIQLTJLKUPO-UHFFFAOYSA-NSynonyms
2(4(13benzodioxol5yl)77dimethyl25dioxo345678hexahydroquinolin1(2H)yl)5678tetrahydro4Hcyclohepta(b)thiophene3carbonitrile
2(4(13benzodioxol5yl)77dimethyl25dioxo3468tetrahydroquinolin1yl)5678tetrahydro4Hcyclohepta(b)thiophene3carbonitrile
CC1(CC2=C(C(CC(=O)N2C3=C(C4=C(S3)CCCCC4)C#N)C5=CC6=C(C=C5)OCO6)C(=O)C1)C
InChI=1SC28H28N2O4Sc128(2)122026(21(31)1328)18(16892223(1016)34153322)1125(32)30(20)2719(1429)176435724(17)3527h81018H37111315H212H3
MFCD07022443
ZINC000012402379
ZINC000012402380
Check stock
See real-time availability and sample size for STK784497 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.