Vitas-M small molecule compound
methyl 2-({[2-(2,4-dichlorophenyl)-3-methylquinolin-4-yl]carbonyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK421548
SMILES COC(=O)c1c(sc2c1CCCCCC2)NC(=O)c1c(C)c(nc2c1cccc2)c1ccc(cc1Cl)Cl
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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 C29H26Cl2N2O3S MW 553.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26Cl2N2O3S/c1-16-24(19-9-7-8-11-22(19)32-26(16)18-14-13-17(30)15-21(18)31)27(34)33-28-25(29(35)36-2)20-10-5-3-4-6-12-23(20)37-28/h7-9,11,13-15H,3-6,10,12H2,1-2H3,(H,33,34)InChIKey
GZHISBDJNBXQAF-UHFFFAOYSA-NSynonyms
5694-19-95694199
CC1=C(C2=CC=CC=C2N=C1C3=C(C=C(C=C3)Cl)Cl)C(=O)NC4=C(C5=C(S4)CCCCCC5)C(=O)OC
InChI=1SC29H26Cl2N2O3Sc11624(199781122(19)3226(16)18141317(30)1521(18)31)27(34)332825(29(35)362)201053461223(20)3728h79111315H361012H212H3(H3334)
METHYL10((2(24DICHLOROPHENYL)3METHYLQUINOLINE4CARBONYL)AMINO)11THIABICYCLO(630)UNDECA912DIENE9CARBOXYLATE
methyl2(((2(24dichlorophenyl)3methylquinolin4yl)carbonyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2((2(24dichlorophenyl)3methylquinoline4carbonyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
MFCD01338746
ZINC000002081386
ZINC02081386
ZINC2081386
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