Vitas-M small molecule compound

dimethyl 5-({[4-(morpholin-4-yl)phenyl]carbamothioyl}amino)benzene-1,3-dicarboxylate

Catalog ID
STK189843
SMILES COC(=O)c1cc(NC(=S)Nc2ccc(cc2)N2CCOCC2)cc(c1)C(=O)OC

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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 C21H23N3O5S MW 429.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O5S/c1-27-19(25)14-11-15(20(26)28-2)13-17(12-14)23-21(30)22-16-3-5-18(6-4-16)24-7-9-29-10-8-24/h3-6,11-13H,7-10H2,1-2H3,(H2,22,23,30)
InChIKey
CLHXPJJSKRUANV-UHFFFAOYSA-N
Synonyms
708290-08-8
708290088
COC(=O)C1=CC(=CC(=C1)NC(=S)NC2=CC=C(C=C2)N3CCOCC3)C(=O)OC
DIMETHYL5(((4(MORPHOLIN4YL)PHENYL)CARBAMOTHIOYL)AMINO)BENZENE13DICARBOXYLATE
DIMETHYL5((4MORPHOLIN4YLPHENYL)CARBAMOTHIOYLAMINO)BENZENE13DICARBOXYLATE
dimethyl5(3(4morpholinophenyl)thioureido)isophthalate
InChI=1SC21H23N3O5Sc12719(25)141115(20(26)282)1317(1214)2321(30)22163518(6416)24792910824h361113H710H212H3(H2222330)
METHYL3(METHOXYCARBONYL)5((((4MORPHOLIN4YLPHENYL)AMINO)THIOXOMETHYL)AMINO)BENZOATE
MFCD05992626
ZINC000002213348
ZINC02213348
ZINC2213348

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Available files

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