Vitas-M small molecule compound

3-butoxy-N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide

Catalog ID
STK184380
SMILES CCCCOc1cccc(c1)C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)c1cccnc1

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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 C24H22N4O3S MW 446.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O3S/c1-2-3-12-30-19-8-4-6-16(13-19)22(29)28-24(32)26-18-9-10-21-20(14-18)27-23(31-21)17-7-5-11-25-15-17/h4-11,13-15H,2-3,12H2,1H3,(H2,26,28,29,32)
InChIKey
XLFSEEZIFVHZMU-UHFFFAOYSA-N
Synonyms

3BUTOXYN((2(PYRIDIN3YL)13BENZOXAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
3BUTOXYN((2PYRIDIN3YL13BENZOXAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CN=CC=C4
InChI=1SC24H22N4O3Sc12312301984616(1319)22(29)2824(32)26189102120(1418)2723(3121)177511251517h4111315H2312H21H3(H226282932)
MFCD03135700
ZINC000002984941
ZINC02984941
ZINC2984941

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Available files

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