Vitas-M small molecule compound

N-(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)-5-(3-nitrophenyl)furan-2-carboxamide

Catalog ID
STK397773
SMILES COc1cc2sc(nc2cc1Cl)NC(=O)c1ccc(o1)c1cccc(c1)[N+](=O)[O-]

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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 C19H12ClN3O5S MW 429.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12ClN3O5S/c1-27-16-9-17-13(8-12(16)20)21-19(29-17)22-18(24)15-6-5-14(28-15)10-3-2-4-11(7-10)23(25)26/h2-9H,1H3,(H,21,22,24)
InChIKey
USRBOLYKKQZFIB-UHFFFAOYSA-N
Synonyms

COC1=C(C=C2C(=C1)SC(=N2)NC(=O)C3=CC=C(O3)C4=CC(=CC=C4)(N+)(=O)(O))Cl
COc1cc2sc(nc2cc1Cl)NC(=O)c1ccc(o1)c1cccc(c1)(N+)(=O)(O)
InChI=1SC19H12ClN3O5Sc1271691713(812(16)20)2119(2917)2218(24)156514(2815)1032411(710)23(25)26h29H1H3(H212224)
MFCD04400820
N(5chloro6methoxy13benzothiazol2yl)5(3nitrophenyl)furan2carboxamide
ZINC000001123251
ZINC01123251
ZINC1123251

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Available files

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