Vitas-M small molecule compound

methyl 3-({[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl}amino)benzoate

Catalog ID
STK653645
SMILES COC(=O)c1cccc(c1)NC(=O)N1CCCC1c1nc2c(s1)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 C20H19N3O3S MW 381.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O3S/c1-26-19(24)13-6-4-7-14(12-13)21-20(25)23-11-5-9-16(23)18-22-15-8-2-3-10-17(15)27-18/h2-4,6-8,10,12,16H,5,9,11H2,1H3,(H,21,25)
InChIKey
JIFGBVXBFMTGCJ-UHFFFAOYSA-N
Synonyms
1144467-22-0
1144467220
COC(=O)C1=CC(=CC=C1)NC(=O)N2CCCC2C3=NC4=CC=CC=C4S3
InChI=1SC20H19N3O3Sc12619(24)1364714(1213)2120(25)23115916(23)1822158231017(15)2718h2468101216H5911H21H3(H2125)
methyl3(((2(13benzothiazol2yl)pyrrolidin1yl)carbonyl)amino)benzoate
methyl3((2(13benzothiazol2yl)pyrrolidine1carbonyl)amino)benzoate
methyl3(2(benzo(d)thiazol2yl)pyrrolidine1carboxamido)benzoate
MFCD12211670
ZINC000032072815
ZINC000032072819

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Available files

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