Vitas-M small molecule compound

N-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-1-(4-fluorobenzyl)-5-oxopyrrolidine-3-carboxamide

Catalog ID
STK650060
SMILES Fc1ccc(cc1)CN1CC(CC1=O)C(=O)/N=c/1\sc2c([nH]1)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 C19H16FN3O2S MW 369.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16FN3O2S/c20-14-7-5-12(6-8-14)10-23-11-13(9-17(23)24)18(25)22-19-21-15-3-1-2-4-16(15)26-19/h1-8,13H,9-11H2,(H,21,22,25)
InChIKey
NEFZABLLYOPRBT-UHFFFAOYSA-N
Synonyms
1144427-54-2
1144427542
C1C(CN(C1=O)CC2=CC=C(C=C2)F)C(=O)NC3=NC4=CC=CC=C4S3
Fc1ccc(cc1)CN1CC(CC1=O)C(=O)N=c1sc2c((nH)1)cccc2
InChI=1SC19H16FN3O2Sc20147512(6814)10231113(917(23)24)18(25)22192115312416(15)2619h1813H911H2(H212225)
MFCD18165487
N((2Z)13benzothiazol2(3H)ylidene)1(4fluorobenzyl)5oxopyrrolidine3carboxamide
N(13benzothiazol2yl)1((4fluorophenyl)methyl)5oxopyrrolidine3carboxamide
ZINC000032088745
ZINC000032088748

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Available files

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