Vitas-M small molecule compound

methyl 4-({[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl}amino)benzoate

Catalog ID
STK647540
SMILES COC(=O)c1ccc(cc1)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)13-8-10-14(11-9-13)21-20(25)23-12-4-6-16(23)18-22-15-5-2-3-7-17(15)27-18/h2-3,5,7-11,16H,4,6,12H2,1H3,(H,21,25)
InChIKey
NYNKWCMHMATNGN-UHFFFAOYSA-N
Synonyms
1144427-91-7
1144427917
COC(=O)C1=CC=C(C=C1)NC(=O)N2CCCC2C3=NC4=CC=CC=C4S3
InChI=1SC20H19N3O3Sc12619(24)1381014(11913)2120(25)23124616(23)182215523717(15)2718h23571116H4612H21H3(H2125)
methyl4(((2(13benzothiazol2yl)pyrrolidin1yl)carbonyl)amino)benzoate
methyl4((2(13benzothiazol2yl)pyrrolidine1carbonyl)amino)benzoate
methyl4(2(benzo(d)thiazol2yl)pyrrolidine1carboxamido)benzoate
MFCD12216930
ZINC000032102308
ZINC000032102310

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Available files

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