Vitas-M small molecule compound
3-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]propyl 2,4-dichlorobenzoate
Catalog ID
STL286921
SMILES Clc1ccc(c(c1)Cl)C(=O)OCCCNC1=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 C17H14Cl2N2O4S MW 413.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14Cl2N2O4S/c18-11-6-7-12(14(19)10-11)17(22)25-9-3-8-20-16-13-4-1-2-5-15(13)26(23,24)21-16/h1-2,4-7,10H,3,8-9H2,(H,20,21)InChIKey
XZWFMKMMYHQTPS-UHFFFAOYSA-NSynonyms
3((11dioxido12benzothiazol3yl)amino)propyl24dichlorobenzoate
3((11DIOXO12BENZOTHIAZOL3YL)AMINO)PROPYL24DICHLOROBENZOATE
3((11DIOXOBENZO(D)12THIAZOLIN3YL)AMINO)PROPYL24DICHLOROBENZOATE
C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCOC(=O)C3=C(C=C(C=C3)Cl)Cl
InChI=1SC17H14Cl2N2O4Sc18116712(14(19)1011)17(22)25938201613412515(13)26(2324)2116h124710H389H2(H2021)
MFCD01235001
ZINC000003663954
ZINC03663954
ZINC3663954
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