Vitas-M small molecule compound

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

Catalog ID
STK317767
SMILES COC(=O)c1c(NC(=S)NC(=O)c2cc(nc3c2cccc3)c2ccccc2)sc2c1CCCC2

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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 C27H23N3O3S2 MW 501.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O3S2/c1-33-26(32)23-18-12-6-8-14-22(18)35-25(23)30-27(34)29-24(31)19-15-21(16-9-3-2-4-10-16)28-20-13-7-5-11-17(19)20/h2-5,7,9-11,13,15H,6,8,12,14H2,1H3,(H2,29,30,31,34)
InChIKey
MQNOMVUAJCFAAI-UHFFFAOYSA-N
Synonyms
445237-80-9
445237809
COC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5
InChI=1SC27H23N3O3S2c13326(32)231812681422(18)3525(23)3027(34)2924(31)191521(1693241016)282013751117(19)20h2579111315H681214H21H3(H229303134)
methyl2((((2phenylquinolin4yl)carbonyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((2phenylquinoline4carbonyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD02609242
ZINC000002108675
ZINC02108675
ZINC2108675

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Available files

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