Vitas-M small molecule compound

2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl diethylcarbamodithioate

Catalog ID
STK039421
SMILES CCN(C(=S)SCC(=O)N1CCc2c(C1)cccc2)CC

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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 C16H22N2OS2 MW 322.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2OS2/c1-3-17(4-2)16(20)21-12-15(19)18-10-9-13-7-5-6-8-14(13)11-18/h5-8H,3-4,9-12H2,1-2H3
InChIKey
TVJBBZVNSRFHBE-UHFFFAOYSA-N
Synonyms
6591-29-3
(2(34DIHYDRO1HISOQUINOLIN2YL)2OXOETHYL)NNDIETHYLCARBAMODITHIOATE
2(34DIHYDROISOQUINOLIN2(1H)YL)2OXOETHYLDIETHYLCARBAMODITHIOATE
6591293
CCN(C(=S)SCC(=O)N1CCc2c(C1)cccc2)CC
CCN(CC)C(=S)SCC(=O)N1CCC2=CC=CC=C2C1
InChI=1SC16H22N2OS2c1317(42)16(20)211215(19)1810913756814(13)1118h58H34912H212H3
MFCD02722440
STK039421
ZINC000004141858
ZINC04141858
ZINC4141858

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Available files

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