Vitas-M small molecule compound
propyl 2-({[2-(3-bromophenyl)quinolin-4-yl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK420308
SMILES CCCOC(=O)c1c(sc2c1CCCCC2)NC(=O)c1cc(nc2c1cccc2)c1cccc(c1)Br
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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 C29H27BrN2O3S MW 563.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27BrN2O3S/c1-2-15-35-29(34)26-21-12-4-3-5-14-25(21)36-28(26)32-27(33)22-17-24(18-9-8-10-19(30)16-18)31-23-13-7-6-11-20(22)23/h6-11,13,16-17H,2-5,12,14-15H2,1H3,(H,32,33)InChIKey
ONKGCWXQOLNOOK-UHFFFAOYSA-NSynonyms
353769-52-5353769525
CCCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)Br
InChI=1SC29H27BrN2O3Sc12153529(34)2621124351425(21)3628(26)3227(33)221724(18981019(30)1618)312313761120(22)23h611131617H25121415H21H3(H3233)
MFCD01921488
propyl2(((2(3bromophenyl)quinolin4yl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
propyl2((2(3bromophenyl)quinoline4carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ZINC000002086362
ZINC02086362
ZINC2086362
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