Vitas-M small molecule compound
methyl 2-({[6-bromo-2-(4-butylphenyl)quinolin-4-yl]carbonyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK427472
SMILES CCCCc1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)Nc1sc2c(c1C(=O)OC)CCC(C2)C)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 C31H31BrN2O3S MW 591.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31BrN2O3S/c1-4-5-6-19-8-10-20(11-9-19)26-17-24(23-16-21(32)12-14-25(23)33-26)29(35)34-30-28(31(36)37-3)22-13-7-18(2)15-27(22)38-30/h8-12,14,16-18H,4-7,13,15H2,1-3H3,(H,34,35)InChIKey
YLVAVPGHTPMVNU-UHFFFAOYSA-NSynonyms
CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C5=C(S4)CC(CC5)C)C(=O)OC
InChI=1SC31H31BrN2O3Sc14561981020(11919)261724(231621(32)121425(23)3326)29(35)343028(31(36)373)2213718(2)1527(22)3830h812141618H471315H213H3(H3435)
methyl2(((6bromo2(4butylphenyl)quinolin4yl)carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
methyl2((6bromo2(4butylphenyl)quinoline4carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
MFCD02612442
ZINC000002783239
ZINC000002783240
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