Vitas-M small molecule compound

N-[(2E)-3,4,5,6,7,8-hexahydro-2H-cyclohepta[d][1,3]thiazol-2-ylidene]-2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide

Catalog ID
STL567769
SMILES COCCn1cc(C(=O)/N=c\2/sc3c([nH]2)CCCCC3)c2c(c1=O)cccc2

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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 C21H23N3O3S MW 397.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O3S/c1-27-12-11-24-13-16(14-7-5-6-8-15(14)20(24)26)19(25)23-21-22-17-9-3-2-4-10-18(17)28-21/h5-8,13H,2-4,9-12H2,1H3,(H,22,23,25)
InChIKey
VVMGDEYPNMYBCB-UHFFFAOYSA-N
Synonyms
1324060-85-6
1324060856
56761126
MFCD32652951
N((2E)345678hexahydro2Hcyclohepta(d)(13)thiazol2ylidene)2(2methoxyethyl)1oxo12dihydroisoquinoline4carboxamide

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Available files

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