Vitas-M small molecule compound

3-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenyl pyridine-3-carboxylate

Catalog ID
STK180055
SMILES O=C(c1cccnc1)Oc1cccc(c1)NC1=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 C19H13N3O4S MW 379.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13N3O4S/c23-19(13-5-4-10-20-12-13)26-15-7-3-6-14(11-15)21-18-16-8-1-2-9-17(16)27(24,25)22-18/h1-12H,(H,21,22)
InChIKey
ZCXQMZCXRBMFFE-UHFFFAOYSA-N
Synonyms

(3((11DIOXO12BENZOTHIAZOL3YL)AMINO)PHENYL)PYRIDINE3CARBOXYLATE
3((11DIOXIDO12BENZISOTHIAZOL3YL)AMINO)PHENYLNICOTINATE
3((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)PHENYLPYRIDINE3CARBOXYLATE
C1=CC=C2C(=C1)C(=NS2(=O)=O)NC3=CC(=CC=C3)OC(=O)C4=CN=CC=C4
InChI=1SC19H13N3O4Sc2319(135410201213)261573614(1115)211816812917(16)27(2425)2218h112H(H2122)
MFCD04084655
ZINC000000796546
ZINC00796546
ZINC796546

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Available files

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