Vitas-M small molecule compound
2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]ethyl azepan-1-ylacetate
Catalog ID
STK135064
SMILES O=C(CN1CCCCCC1)OCCNC1=NS(=O)(=O)c2c1cccc2
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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 C17H23N3O4S MW 365.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N3O4S/c21-16(13-20-10-5-1-2-6-11-20)24-12-9-18-17-14-7-3-4-8-15(14)25(22,23)19-17/h3-4,7-8H,1-2,5-6,9-13H2,(H,18,19)InChIKey
QMZRTZAADUKIPI-UHFFFAOYSA-NSynonyms
2((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)ETHYLAZEPAN1YLACETATE
2((11DIOXO12BENZOTHIAZOL3YL)AMINO)ETHYL2(AZEPAN1YL)ACETATE
2((11DIOXOBENZO(D)12THIAZOLIN3YL)AMINO)ETHYL2AZAPERHYDROEPINYLACETATE
AZEPAN1YLACETICACID2(11DIOXO1H1LAMBDA6BENZO(D)ISOTHIAZOL3YLAMINO)ETHYLESTER
C1CCCN(CC1)CC(=O)OCCNC2=NS(=O)(=O)C3=CC=CC=C32
InChI=1SC17H23N3O4Sc2116(13201051261120)24129181714734815(14)25(2223)1917h3478H1256913H2(H1819)
MFCD02737897
ZINC000002479985
ZINC2479985
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