Vitas-M small molecule compound

methyl 2-{[(3-methoxyphenyl)carbamothioyl]amino}-4,5-dimethylthiophene-3-carboxylate

Catalog ID
STK437353
SMILES COc1cccc(c1)NC(=S)Nc1sc(c(c1C(=O)OC)C)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 C16H18N2O3S2 MW 350.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O3S2/c1-9-10(2)23-14(13(9)15(19)21-4)18-16(22)17-11-6-5-7-12(8-11)20-3/h5-8H,1-4H3,(H2,17,18,22)
InChIKey
HXAXBKZOKMUELO-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC(=CC=C2)OC)C
InChI=1SC16H18N2O3S2c1910(2)2314(13(9)15(19)214)1816(22)171165712(811)203h58H14H3(H2171822)
METHYL2((((3METHOXYPHENYL)AMINO)THIOXOMETHYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
methyl2(((3methoxyphenyl)carbamothioyl)amino)45dimethylthiophene3carboxylate
METHYL2((3METHOXYPHENYL)CARBAMOTHIOYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD03944927
ZINC000002858304
ZINC02858304
ZINC2858304

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Available files

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