Vitas-M small molecule compound

ethyl 2-[(phenylcarbamothioyl)amino]-6-(2-phenylethyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate

Catalog ID
STK016801
SMILES CCOC(=O)c1c(NC(=S)Nc2ccccc2)sc2c1CCN(C2)CCc1ccccc1

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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 C25H27N3O2S2 MW 465.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O2S2/c1-2-30-24(29)22-20-14-16-28(15-13-18-9-5-3-6-10-18)17-21(20)32-23(22)27-25(31)26-19-11-7-4-8-12-19/h3-12H,2,13-17H2,1H3,(H2,26,27,31)
InChIKey
NZDPZXCOAQRBSV-UHFFFAOYSA-N
Synonyms
351008-71-4
2((ANILINO(SULFANYLIDENE)METHYL)AMINO)6(2PHENYLETHYL)57DIHYDRO4HTHIENO(23C)PYRIDINE3CARBOXYLICACIDETHYLESTER
351008714
6PHENETHYL2(PHENYLTHIOCARBAMOYLAMINO)57DIHYDRO4HTHIENO(23C)PYRIDINE3CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(SC2=C1CCN(C2)CCC3=CC=CC=C3)NC(=S)NC4=CC=CC=C4
CCOC(=O)c1c(NC(=S)Nc2ccccc2)sc2c1CCN(C2)CCc1ccccc1
ethyl2((phenylcarbamothioyl)amino)6(2phenylethyl)4567tetrahydrothieno(23c)pyridine3carboxylate
ETHYL2(PHENYLCARBAMOTHIOYLAMINO)6(2PHENYLETHYL)57DIHYDRO4HTHIENO(23C)PYRIDINE3CARBOXYLATE
ethyl6phenethyl2(3phenylthioureido)4567tetrahydrothieno(23c)pyridine3carboxylate
ETHYL6PHENETHYL2(PHENYLCARBAMOTHIOYLAMINO)57DIHYDRO4HTHIENO(23C)PYRIDINE3CARBOXYLATE
InChI=1SC25H27N3O2S2c123024(29)2220141628(15131895361018)1721(20)3223(22)2725(31)2619117481219h312H21317H21H3(H2262731)
MFCD01560305
STK016801
ZINC000013756143
ZINC13756143

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Available files

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