Vitas-M small molecule compound

diethyl 2-({[5-ethyl-3-(methoxycarbonyl)thiophen-2-yl]carbamothioyl}amino)benzene-1,4-dicarboxylate

Catalog ID
STK455553
SMILES CCOC(=O)c1ccc(cc1NC(=S)Nc1sc(cc1C(=O)OC)CC)C(=O)OCC

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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 C21H24N2O6S2 MW 464.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O6S2/c1-5-13-11-15(19(25)27-4)17(31-13)23-21(30)22-16-10-12(18(24)28-6-2)8-9-14(16)20(26)29-7-3/h8-11H,5-7H2,1-4H3,(H2,22,23,30)
InChIKey
WAXXOFDWMCHXFH-UHFFFAOYSA-N
Synonyms

CCC1=CC(=C(S1)NC(=S)NC2=C(C=CC(=C2)C(=O)OCC)C(=O)OCC)C(=O)OC
diethyl2(((5ethyl3(methoxycarbonyl)thiophen2yl)carbamothioyl)amino)benzene14dicarboxylate
DIETHYL2((5ETHYL3METHOXYCARBONYLTHIOPHEN2YL)CARBAMOTHIOYLAMINO)BENZENE14DICARBOXYLATE
InChI=1SC21H24N2O6S2c15131115(19(25)274)17(3113)2321(30)22161012(18(24)2862)8914(16)20(26)2973h811H57H214H3(H2222330)
METHYL2((((25BIS(ETHOXYCARBONYL)PHENYL)AMINO)THIOXOMETHYL)AMINO)5ETHYLTHIOPHENE3CARBOXYLATE
MFCD04227669
ZINC000016361001
ZINC16361001

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Available files

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