Vitas-M small molecule compound
2-(4-bromophenyl)-N-(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-4-carboxamide
Catalog ID
STK419283
SMILES Brc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)Nc1sc2c(c1C(=O)N)CCC(C2)C(C)(C)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 C29H28BrN3O2S MW 562.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28BrN3O2S/c1-29(2,3)17-10-13-20-24(14-17)36-28(25(20)26(31)34)33-27(35)21-15-23(16-8-11-18(30)12-9-16)32-22-7-5-4-6-19(21)22/h4-9,11-12,15,17H,10,13-14H2,1-3H3,(H2,31,34)(H,33,35)InChIKey
BYTNHKHEYPZNNL-UHFFFAOYSA-NSynonyms
352683-09-12(4bromophenyl)N(6tertbutyl3carbamoyl4567tetrahydro1benzothiophen2yl)quinoline4carboxamide
352683091
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Br
InChI=1SC29H28BrN3O2Sc129(23)1710132024(1417)3628(25(20)26(31)34)3327(35)211523(1681118(30)12916)3222754619(21)22h4911121517H101314H213H3(H23134)(H3335)
MFCD01352857
ZINC000002740095
ZINC000002740096
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