Vitas-M small molecule compound
6-bromo-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(4-methylphenyl)quinoline-4-carboxamide
Catalog ID
STK443869
SMILES N#Cc1c(sc2c1CCCCC2)NC(=O)c1cc(nc2c1cc(Br)cc2)c1ccc(cc1)C
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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 C27H22BrN3OS MW 516.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22BrN3OS/c1-16-7-9-17(10-8-16)24-14-21(20-13-18(28)11-12-23(20)30-24)26(32)31-27-22(15-29)19-5-3-2-4-6-25(19)33-27/h7-14H,2-6H2,1H3,(H,31,32)InChIKey
NXFQOBZLVVKXOD-UHFFFAOYSA-NSynonyms
6bromoN(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)2(4methylphenyl)quinoline4carboxamide
CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C5=C(S4)CCCCC5)C#N
InChI=1SC27H22BrN3OSc1167917(10816)241421(201318(28)111223(20)3024)26(32)312722(1529)195324625(19)3327h714H26H21H3(H3132)
MFCD02176465
ZINC000002088914
ZINC02088914
ZINC2088914
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