Vitas-M small molecule compound
ethyl 2-({[2-amino-1-(4-bromophenyl)-1H-pyrrolo[2,3-b]quinoxalin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK538287
SMILES CCOC(=O)c1c(sc2c1CCCC2)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)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 C28H24BrN5O3S MW 590.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24BrN5O3S/c1-2-37-28(36)21-17-7-3-6-10-20(17)38-27(21)33-26(35)22-23-25(32-19-9-5-4-8-18(19)31-23)34(24(22)30)16-13-11-15(29)12-14-16/h4-5,8-9,11-14H,2-3,6-7,10,30H2,1H3,(H,33,35)InChIKey
LPRQXXNBJLLGOE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(N(C4=NC5=CC=CC=C5N=C34)C6=CC=C(C=C6)Br)N
ethyl2(((2amino1(4bromophenyl)1Hpyrrolo(23b)quinoxalin3yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2amino1(4bromophenyl)pyrrolo(32b)quinoxaline3carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(2amino1(4bromophenyl)1Hpyrrolo(23b)quinoxaline3carboxamido)4567tetrahydrobenzo(b)thiophene3carboxylate
InChI=1SC28H24BrN5O3Sc123728(36)21177361020(17)3827(21)3326(35)222325(3219954818(19)3123)34(24(22)30)16131115(29)121416h45891114H23671030H21H3(H3335)
MFCD03000978
ZINC000001851322
ZINC01851322
ZINC1851322
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