Vitas-M small molecule compound
6-bromo-2-(4-butylphenyl)-N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)quinoline-4-carboxamide
Catalog ID
STK428770
SMILES CCCCc1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)Nc1sc2c(c1C(=O)N)CCCCC2)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 C30H30BrN3O2S MW 576.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30BrN3O2S/c1-2-3-7-18-10-12-19(13-11-18)25-17-23(22-16-20(31)14-15-24(22)33-25)29(36)34-30-27(28(32)35)21-8-5-4-6-9-26(21)37-30/h10-17H,2-9H2,1H3,(H2,32,35)(H,34,36)InChIKey
LKQVLRNINIJDPO-UHFFFAOYSA-NSynonyms
6bromo2(4butylphenyl)N(3carbamoyl5678tetrahydro4Hcyclohepta(b)thiophen2yl)quinoline4carboxamide
CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C5=C(S4)CCCCC5)C(=O)N
InChI=1SC30H30BrN3O2Sc123718101219(131118)251723(221620(31)141524(22)3325)29(36)343027(28(32)35)218546926(21)3730h1017H29H21H3(H23235)(H3436)
MFCD03233305
ZINC000002789373
ZINC02789373
ZINC2789373
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