Vitas-M small molecule compound

N-cyclopentyl-2-{[(4-hydroxy-6,7-dimethoxyquinazolin-2-yl)methyl]sulfanyl}acetamide

Catalog ID
STK647401
SMILES COc1cc2nc(CSCC(=O)NC3CCCC3)nc(c2cc1OC)O

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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 C18H23N3O4S MW 377.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O4S/c1-24-14-7-12-13(8-15(14)25-2)20-16(21-18(12)23)9-26-10-17(22)19-11-5-3-4-6-11/h7-8,11H,3-6,9-10H2,1-2H3,(H,19,22)(H,20,21,23)
InChIKey
XSIRXKAIRJOJPT-UHFFFAOYSA-N
Synonyms
1007654-78-5
1007654785
COC1=C(C=C2C(=C1)C(=O)N=C(N2)CSCC(=O)NC3CCCC3)OC
InChI=1SC18H23N3O4Sc1241471213(815(14)252)2016(2118(12)23)9261017(22)1911534611h7811H36910H212H3(H1922)(H202123)
MFCD18164558
Ncyclopentyl2(((4hydroxy67dimethoxyquinazolin2yl)methyl)sulfanyl)acetamide
Ncyclopentyl2((67dimethoxy4oxo1Hquinazolin2yl)methylsulfanyl)acetamide
ZINC000011866077
ZINC11866077

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Available files

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