Vitas-M small molecule compound

methyl 4-ethyl-5-methyl-2-{[(1-phenylethyl)carbamothioyl]amino}thiophene-3-carboxylate

Catalog ID
STK436709
SMILES COC(=O)c1c(NC(=S)NC(c2ccccc2)C)sc(c1CC)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 C18H22N2O2S2 MW 362.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O2S2/c1-5-14-12(3)24-16(15(14)17(21)22-4)20-18(23)19-11(2)13-9-7-6-8-10-13/h6-11H,5H2,1-4H3,(H2,19,20,23)
InChIKey
POJZYRIRDGDWSI-UHFFFAOYSA-N
Synonyms

CCC1=C(SC(=C1C(=O)OC)NC(=S)NC(C)C2=CC=CC=C2)C
InChI=1SC18H22N2O2S2c151412(3)2416(15(14)17(21)224)2018(23)1911(2)1397681013h611H5H214H3(H2192023)
METHYL4ETHYL5METHYL2((((PHENYLETHYL)AMINO)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
methyl4ethyl5methyl2(((1phenylethyl)carbamothioyl)amino)thiophene3carboxylate
METHYL4ETHYL5METHYL2(1PHENYLETHYLCARBAMOTHIOYLAMINO)THIOPHENE3CARBOXYLATE
MFCD03945129
ZINC000017074643
ZINC000017074644

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Available files

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