Vitas-M small molecule compound

ethyl 2-amino-7-cyclohexyl-6,8-dioxo-5,5a,6,7,8,8a-hexahydro-4H-thieno[2,3-e]isoindole-3-carboxylate

Catalog ID
STK079834
SMILES CCOC(=O)c1c(N)sc2c1CCC1C2C(=O)N(C1=O)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 C19H24N2O4S MW 376.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N2O4S/c1-2-25-19(24)14-11-8-9-12-13(15(11)26-16(14)20)18(23)21(17(12)22)10-6-4-3-5-7-10/h10,12-13H,2-9,20H2,1H3
InChIKey
IQOIFVALVZGMDY-UHFFFAOYSA-N
Synonyms
354551-36-3
2AMINO7CYCLOHEXYL68DIKETO455A8ATETRAHYDROTHIEN(23E)ISOINDOLE3CARBOXYLICACIDETHYLESTER
2AMINO7CYCLOHEXYL68DIOXO455A8ATETRAHYDROTHIENO(23E)ISOINDOLE3CARBOXYLICACIDETHYLESTER
354551363
CCOC(=O)C1=C(SC2=C1CCC3C2C(=O)N(C3=O)C4CCCCC4)N
CCOC(=O)c1c(N)sc2c1CCC1C2C(=O)N(C1=O)C1CCCCC1
ETHYL2AMINO7CYCLOHEXYL68DIOXO455A8ATETRAHYDROTHIENO(23E)ISOINDOLE3CARBOXYLATE
ethyl2amino7cyclohexyl68dioxo55a6788ahexahydro4Hthieno(23e)isoindole3carboxylate
ETHYL2AZANYL7CYCLOHEXYL68BIS(OXIDANYLIDENE)455A8ATETRAHYDROTHIENO(23E)ISOINDOLE3CARBOXYLATE
InChI=1SC19H24N2O4Sc122519(24)1411891213(15(11)2616(14)20)18(23)21(17(12)22)106435710h101213H2920H21H3
MFCD01244491
STK079834
ZINC000002254567
ZINC000100435629

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Available files

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