Vitas-M small molecule compound
2-[(1,1-dioxido-1,2-benzothiazol-3-yl)sulfanyl]ethyl 4-chlorobenzoate
Catalog ID
STL287218
SMILES Clc1ccc(cc1)C(=O)OCCSC1=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 C16H12ClNO4S2 MW 381.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClNO4S2/c17-12-7-5-11(6-8-12)16(19)22-9-10-23-15-13-3-1-2-4-14(13)24(20,21)18-15/h1-8H,9-10H2InChIKey
NRRWICBPDWIFLE-UHFFFAOYSA-NSynonyms
2((11dioxido12benzothiazol3yl)sulfanyl)ethyl4chlorobenzoate
2((11dioxo12benzothiazol3yl)sulfanyl)ethyl4chlorobenzoate
C1=CC=C2C(=C1)C(=NS2(=O)=O)SCCOC(=O)C3=CC=C(C=C3)Cl
InChI=1SC16H12ClNO4S2c17127511(6812)16(19)22910231513312414(13)24(2021)1815h18H910H2
MFCD01230315
ZINC000059502539
ZINC59502539
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