Vitas-M small molecule compound

ethyl 2-[(N-tert-butylglycyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Catalog ID
STK022270
SMILES CCOC(=O)c1c(NC(=O)CNC(C)(C)C)sc2c1CCCCC2

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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 C18H28N2O3S MW 352.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H28N2O3S/c1-5-23-17(22)15-12-9-7-6-8-10-13(12)24-16(15)20-14(21)11-19-18(2,3)4/h19H,5-11H2,1-4H3,(H,20,21)
InChIKey
BJISNFLTCOIIPH-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)CNC(C)(C)C
CCOC(=O)c1c(NC(=O)CNC(C)(C)C)sc2c1CCCCC2
ethyl2((2(tertbutylamino)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2((Ntertbutylglycyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC18H28N2O3Sc152317(22)151297681013(12)2416(15)2014(21)111918(23)4h19H511H214H3(H2021)
MFCD01177075
STK022270
ZINC000003683231
ZINC3683231

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Available files

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