Vitas-M small molecule compound

methyl 2-{[(5-chloro-2,4-dimethoxyphenyl)carbamothioyl]amino}-5-ethylthiophene-3-carboxylate

Catalog ID
STK455536
SMILES CCc1sc(c(c1)C(=O)OC)NC(=S)Nc1cc(Cl)c(cc1OC)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 C17H19ClN2O4S2 MW 414.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19ClN2O4S2/c1-5-9-6-10(16(21)24-4)15(26-9)20-17(25)19-12-7-11(18)13(22-2)8-14(12)23-3/h6-8H,5H2,1-4H3,(H2,19,20,25)
InChIKey
SJXNTAMETGWZHF-UHFFFAOYSA-N
Synonyms

CCC1=CC(=C(S1)NC(=S)NC2=CC(=C(C=C2OC)OC)Cl)C(=O)OC
InChI=1SC17H19ClN2O4S2c159610(16(21)244)15(269)2017(25)1912711(18)13(222)814(12)233h68H5H214H3(H2192025)
METHYL2((((5CHLORO24DIMETHOXYPHENYL)AMINO)THIOXOMETHYL)AMINO)5ETHYLTHIOPHENE3CARBOXYLATE
methyl2(((5chloro24dimethoxyphenyl)carbamothioyl)amino)5ethylthiophene3carboxylate
METHYL2((5CHLORO24DIMETHOXYPHENYL)CARBAMOTHIOYLAMINO)5ETHYLTHIOPHENE3CARBOXYLATE
MFCD04228174
ZINC000001121418
ZINC01121418
ZINC1121418

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.