Vitas-M small molecule compound

3-[(1,1-dioxido-1,2-benzothiazol-3-yl)(phenyl)amino]propyl benzoate

Catalog ID
STK137737
SMILES O=C(c1ccccc1)OCCCN(C1=NS(=O)(=O)c2c1cccc2)c1ccccc1

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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 C23H20N2O4S MW 420.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O4S/c26-23(18-10-3-1-4-11-18)29-17-9-16-25(19-12-5-2-6-13-19)22-20-14-7-8-15-21(20)30(27,28)24-22/h1-8,10-15H,9,16-17H2
InChIKey
ULRZQRKBOCHEMN-UHFFFAOYSA-N
Synonyms

3((11DIOXIDO12BENZOTHIAZOL3YL)(PHENYL)AMINO)PROPYLBENZOATE
3((11DIOXOBENZO(D)12THIAZOLIN3YL)PHENYLAMINO)PROPYLBENZOATE
3(N(11DIOXO12BENZOTHIAZOL3YL)ANILINO)PROPYLBENZOATE
BENZOICACID3((11DIOXO1H1LAMBDA6BENZO(D)ISOTHIAZOL3YL)PHENYLAMINO)PROPYLESTER
C1=CC=C(C=C1)C(=O)OCCCN(C2=CC=CC=C2)C3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC23H20N2O4Sc2623(18103141118)291791625(19125261319)222014781521(20)30(2728)2422h181015H91617H2
MFCD01230319
ZINC000004046595
ZINC04046595
ZINC4046595

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Available files

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