Vitas-M small molecule compound

propyl 6-methyl-2-({[2-(4-methylphenyl)quinolin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK442215
SMILES CCCOC(=O)c1c(NC(=O)c2cc(nc3c2cccc3)c2ccc(cc2)C)sc2c1CCC(C2)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 C30H30N2O3S MW 498.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N2O3S/c1-4-15-35-30(34)27-22-14-11-19(3)16-26(22)36-29(27)32-28(33)23-17-25(20-12-9-18(2)10-13-20)31-24-8-6-5-7-21(23)24/h5-10,12-13,17,19H,4,11,14-16H2,1-3H3,(H,32,33)
InChIKey
FAIOSKZEXXEWHV-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C
InChI=1SC30H30N2O3Sc14153530(34)2722141119(3)1626(22)3629(27)3228(33)231725(2012918(2)101320)3124865721(23)24h51012131719H4111416H213H3(H3233)
MFCD01338270
propyl6methyl2(((2(4methylphenyl)quinolin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
propyl6methyl2((2(4methylphenyl)quinoline4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000002736509
ZINC000002736510

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Available files

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