Vitas-M small molecule compound

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-oxo-1,2-benzothiazol-2(3H)-yl)propanamide

Catalog ID
STK937687
SMILES O=C(Nc1ccc2c(c1)OCCO2)CCn1sc2c(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 C18H16N2O4S MW 356.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O4S/c21-17(19-12-5-6-14-15(11-12)24-10-9-23-14)7-8-20-18(22)13-3-1-2-4-16(13)25-20/h1-6,11H,7-10H2,(H,19,21)
InChIKey
LSRGUJGYDOCRAY-UHFFFAOYSA-N
Synonyms
1219566-06-9
1219566069
C1COC2=C(O1)C=CC(=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4S3
InChI=1SC18H16N2O4Sc2117(1912561415(1112)241092314)782018(22)13312416(13)2520h1611H710H2(H1921)
MFCD16625905
N(23dihydro14benzodioxin6yl)3(3oxo12benzothiazol2(3H)yl)propanamide
N(23dihydro14benzodioxin6yl)3(3oxo12benzothiazol2yl)propanamide
N(23dihydrobenzo(b)(14)dioxin6yl)3(3oxobenzo(d)isothiazol2(3H)yl)propanamide
ZINC000040285541
ZINC40285541

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Available files

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