Vitas-M small molecule compound

diethyl 2-[(phenylcarbamothioyl)amino]-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate

Catalog ID
STK000845
SMILES CCOC(=O)c1c(NC(=S)Nc2ccccc2)sc2c1CCN(C2)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 C20H23N3O4S2 MW 433.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O4S2/c1-3-26-18(24)16-14-10-11-23(20(25)27-4-2)12-15(14)29-17(16)22-19(28)21-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3,(H2,21,22,28)
InChIKey
HOVZGFGAERDHMZ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC2=C1CCN(C2)C(=O)OCC)NC(=S)NC3=CC=CC=C3
CCOC(=O)c1c(NC(=S)Nc2ccccc2)sc2c1CCN(C2)C(=O)OCC
DIETHYL2((ANILINOCARBOTHIOYL)AMINO)47DIHYDROTHIENO(23C)PYRIDINE36(5H)DICARBOXYLATE
DIETHYL2((PHENYLCARBAMOTHIOYL)AMINO)47DIHYDROTHIENO(23C)PYRIDINE36(5H)DICARBOXYLATE
DIETHYL2(PHENYLCARBAMOTHIOYLAMINO)57DIHYDRO4HTHIENO(23C)PYRIDINE36DICARBOXYLATE
InChI=1SC20H23N3O4S2c132618(24)1614101123(20(25)2742)1215(14)2917(16)2219(28)21138657913h59H341012H212H3(H2212228)
MFCD01824266
STK000845
ZINC000001036194
ZINC01036194
ZINC1036194

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Available files

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