Vitas-M small molecule compound

ethyl 2-[({[6-(pyrrolidin-1-yl)pyrimidin-4-yl]sulfanyl}acetyl)amino]benzoate

Catalog ID
STL079834
SMILES CCOC(=O)c1ccccc1NC(=O)CSc1ncnc(c1)N1CCCC1

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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 C19H22N4O3S MW 386.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4O3S/c1-2-26-19(25)14-7-3-4-8-15(14)22-17(24)12-27-18-11-16(20-13-21-18)23-9-5-6-10-23/h3-4,7-8,11,13H,2,5-6,9-10,12H2,1H3,(H,22,24)
InChIKey
LIBZDJKFVZYOFP-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=CC=C1NC(=O)CSC2=NC=NC(=C2)N3CCCC3
ethyl2((((6(pyrrolidin1yl)pyrimidin4yl)sulfanyl)acetyl)amino)benzoate
ethyl2((2(6pyrrolidin1ylpyrimidin4yl)sulfanylacetyl)amino)benzoate
ETHYL2(2((6(PYRROLIDIN1YL)PYRIMIDIN4YL)THIO)ACETAMIDO)BENZOATE
InChI=1SC19H22N4O3Sc122619(25)14734815(14)2217(24)1227181116(20132118)239561023h34781113H25691012H21H3(H2224)
MFCD14201439
ZINC000035528073
ZINC35528073

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Available files

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