Vitas-M small molecule compound
methyl 2-({[6-bromo-2-(3,4-dimethylphenyl)quinolin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK427277
SMILES COC(=O)c1c(sc2c1CCCC2)NC(=O)c1cc(nc2c1cc(Br)cc2)c1ccc(c(c1)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 C28H25BrN2O3S MW 549.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25BrN2O3S/c1-15-8-9-17(12-16(15)2)23-14-21(20-13-18(29)10-11-22(20)30-23)26(32)31-27-25(28(33)34-3)19-6-4-5-7-24(19)35-27/h8-14H,4-7H2,1-3H3,(H,31,32)InChIKey
BVVBSYPGGBHQNU-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)OC)C
InChI=1SC28H25BrN2O3Sc1158917(1216(15)2)231421(201318(29)101122(20)3023)26(32)312725(28(33)343)19645724(19)3527h814H47H213H3(H3132)
methyl2(((6bromo2(34dimethylphenyl)quinolin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((6bromo2(34dimethylphenyl)quinoline4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD02612150
ZINC000002108191
ZINC02108191
ZINC2108191
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