Vitas-M small molecule compound

propyl 4-{[(3-oxo-1,2-benzothiazol-2(3H)-yl)acetyl]amino}benzoate

Catalog ID
STK941188
SMILES CCCOC(=O)c1ccc(cc1)NC(=O)Cn1sc2c(c1=O)cccc2

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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 C19H18N2O4S MW 370.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O4S/c1-2-11-25-19(24)13-7-9-14(10-8-13)20-17(22)12-21-18(23)15-5-3-4-6-16(15)26-21/h3-10H,2,11-12H2,1H3,(H,20,22)
InChIKey
WYPRALUJJZIUMB-UHFFFAOYSA-N
Synonyms
1190266-27-3
1190266273
CCCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3S2
InChI=1SC19H18N2O4Sc12112519(24)137914(10813)2017(22)122118(23)15534616(15)2621h310H21112H21H3(H2022)
MFCD13759534
propyl4(((3oxo12benzothiazol2(3H)yl)acetyl)amino)benzoate
propyl4((2(3oxo12benzothiazol2yl)acetyl)amino)benzoate
propyl4(2(3oxobenzo(d)isothiazol2(3H)yl)acetamido)benzoate
ZINC000036360342
ZINC36360342

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Available files

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