Vitas-M small molecule compound
propan-2-yl 2-({[2-(4-chlorophenyl)quinolin-4-yl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK427911
SMILES Clc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)Nc1sc2c(c1C(=O)OC(C)C)CCCCC2
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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 C29H27ClN2O3S MW 519.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClN2O3S/c1-17(2)35-29(34)26-21-9-4-3-5-11-25(21)36-28(26)32-27(33)22-16-24(18-12-14-19(30)15-13-18)31-23-10-7-6-8-20(22)23/h6-8,10,12-17H,3-5,9,11H2,1-2H3,(H,32,33)InChIKey
VOFZXBSZGYJFFV-UHFFFAOYSA-NSynonyms
CC(C)OC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Cl
InChI=1SC29H27ClN2O3Sc117(2)3529(34)262194351125(21)3628(26)3227(33)221624(18121419(30)151318)31231076820(22)23h68101217H35911H212H3(H3233)
MFCD01352847
propan2yl2(((2(4chlorophenyl)quinolin4yl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
propan2yl2((2(4chlorophenyl)quinoline4carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ZINC000002741309
ZINC02741309
ZINC2741309
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