Vitas-M small molecule compound

3,4,5-trimethoxy-N-{[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide

Catalog ID
STK863914
SMILES COc1cc(cc(c1OC)OC)C(=O)NC(=S)Nc1cccc(c1)c1nc2c(o1)cccn2

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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 C23H20N4O5S MW 464.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O5S/c1-29-17-11-14(12-18(30-2)19(17)31-3)21(28)27-23(33)25-15-7-4-6-13(10-15)22-26-20-16(32-22)8-5-9-24-20/h4-12H,1-3H3,(H2,25,27,28,33)
InChIKey
BKQRMMLYFRFOCM-UHFFFAOYSA-N
Synonyms
385390-16-9
1(3OXAZOLO(45B)PYRIDIN2YLPHENYL)3(345TRIMETHOXYBENZOYL)THIOUREA
345trimethoxyN((3((13)oxazolo(45b)pyridin2yl)phenyl)carbamothioyl)benzamide
345trimethoxyN((3(oxazolo(45b)pyridin2yl)phenyl)carbamothioyl)benzamide
385390169
COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=CC=CC(=C2)C3=NC4=C(O3)C=CC=N4
InChI=1SC23H20N4O5Sc129171114(1218(302)19(17)313)21(28)2723(33)251574613(1015)22262016(3222)8592420h412H13H3(H225272833)
MFCD02734567
N(3(13)OXAZOLO(45B)PYRIDIN2YLPHENYL)N(345TRIMETHOXYBENZOYL)THIOUREA
ZINC000000881699
ZINC00881699
ZINC881699

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Available files

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