Vitas-M small molecule compound
methyl 2-{[({2-[3-(2-methylpropoxy)phenyl]quinolin-4-yl}carbonyl)carbamothioyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK301395
SMILES COC(=O)c1c(NC(=S)NC(=O)c2cc(nc3c2cccc3)c2cccc(c2)OCC(C)C)sc2c1CCC2
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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 C30H29N3O4S2 MW 559.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O4S2/c1-17(2)16-37-19-9-6-8-18(14-19)24-15-22(20-10-4-5-12-23(20)31-24)27(34)32-30(38)33-28-26(29(35)36-3)21-11-7-13-25(21)39-28/h4-6,8-10,12,14-15,17H,7,11,13,16H2,1-3H3,(H2,32,33,34,38)InChIKey
CVULTCVWUHMLOY-UHFFFAOYSA-NSynonyms
438195-62-1438195621
CC(C)COC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(=S)NC4=C(C5=C(S4)CCC5)C(=O)OC
InChI=1SC30H29N3O4S2c117(2)16371996818(1419)241522(2010451223(20)3124)27(34)3230(38)332826(29(35)363)211171325(21)3928h4681012141517H7111316H213H3(H232333438)
METHYL2(((((2(3ISOBUTOXYPHENYL)4QUINOLINYL)CARBONYL)AMINO)CARBOTHIOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
methyl2((((2(3(2methylpropoxy)phenyl)quinolin4yl)carbonyl)carbamothioyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2((2(3(2METHYLPROPOXY)PHENYL)QUINOLINE4CARBONYL)CARBAMOTHIOYLAMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
MFCD03073841
ZINC000002777264
ZINC02777264
ZINC2777264
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.