Vitas-M small molecule compound

7-methyl-1-oxo-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3,4-dihydro-1H-isochromene-3-carboxamide

Catalog ID
STL021789
SMILES Cc1ccc2c(c1)C(=O)OC(C2)C(=O)Nc1nc2c(s1)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 C18H18N2O3S MW 342.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O3S/c1-10-6-7-11-9-14(23-17(22)12(11)8-10)16(21)20-18-19-13-4-2-3-5-15(13)24-18/h6-8,14H,2-5,9H2,1H3,(H,19,20,21)
InChIKey
QWYPVEAYLBIXSJ-UHFFFAOYSA-N
Synonyms
853890-31-0
7methyl1oxoN(4567tetrahydro13benzothiazol2yl)34dihydro1Hisochromene3carboxamide
7methyl1oxoN(4567tetrahydro13benzothiazol2yl)34dihydroisochromene3carboxamide
853890310
CC1=CC2=C(CC(OC2=O)C(=O)NC3=NC4=C(S3)CCCC4)C=C1
InChI=1SC18H18N2O3Sc1106711914(2317(22)12(11)810)16(21)20181913423515(13)2418h6814H259H21H3(H192021)
MFCD06438611
ZINC000004540061
ZINC000004540062

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Available files

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