Vitas-M small molecule compound

ethyl 2-[(2,3-dihydro-1H-indol-1-ylcarbonothioyl)amino]-5-phenylthiophene-3-carboxylate

Catalog ID
STK438599
SMILES CCOC(=O)c1cc(sc1NC(=S)N1CCc2c1cccc2)c1ccccc1

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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 C22H20N2O2S2 MW 408.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O2S2/c1-2-26-21(25)17-14-19(16-9-4-3-5-10-16)28-20(17)23-22(27)24-13-12-15-8-6-7-11-18(15)24/h3-11,14H,2,12-13H2,1H3,(H,23,27)
InChIKey
MOUGVVVOFSWADB-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)N3CCC4=CC=CC=C43
ethyl2((23dihydro1Hindol1ylcarbonothioyl)amino)5phenylthiophene3carboxylate
ETHYL2((INDOLINYLTHIOXOMETHYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
ETHYL2(23DIHYDROINDOLE1CARBOTHIOYLAMINO)5PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC22H20N2O2S2c122621(25)171419(1694351016)2820(17)2322(27)241312158671118(15)24h31114H21213H21H3(H2327)
MFCD03945541
ZINC000005948070
ZINC05948070
ZINC5948070

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Available files

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