Vitas-M small molecule compound

methyl 4-[(2,3-dihydro-1H-indol-1-ylcarbonothioyl)amino]-4-oxobutanoate

Catalog ID
STK119731
SMILES COC(=O)CCC(=O)NC(=S)N1CCc2c1cccc2

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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 C14H16N2O3S MW 292.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2O3S/c1-19-13(18)7-6-12(17)15-14(20)16-9-8-10-4-2-3-5-11(10)16/h2-5H,6-9H2,1H3,(H,15,17,20)
InChIKey
YTMAUPXJRLCBEJ-UHFFFAOYSA-N
Synonyms

COC(=O)CCC(=O)NC(=S)N1CCC2=CC=CC=C21
InChI=1SC14H16N2O3Sc11913(18)7612(17)1514(20)169810423511(10)16h25H69H21H3(H151720)
METHYL3(N(INDOLINYLTHIOXOMETHYL)CARBAMOYL)PROPANOATE
METHYL4((23DIHYDRO1HINDOL1YLCARBONOTHIOYL)AMINO)4OXOBUTANOATE
METHYL4(23DIHYDROINDOLE1CARBOTHIOYLAMINO)4OXOBUTANOATE
MFCD03586644
ZINC000004676081
ZINC04676081
ZINC4676081

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Available files

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