Vitas-M small molecule compound

N-{[4-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-3-chloro-4-ethoxybenzamide

Catalog ID
STK173825
SMILES CCOc1ccc(cc1Cl)C(=O)NC(=S)Nc1ccc(cc1)c1nc2c(o1)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 C23H18ClN3O3S MW 451.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN3O3S/c1-2-29-19-12-9-15(13-17(19)24)21(28)27-23(31)25-16-10-7-14(8-11-16)22-26-18-5-3-4-6-20(18)30-22/h3-13H,2H2,1H3,(H2,25,27,28,31)
InChIKey
WGCSCFCJNYVPOO-UHFFFAOYSA-N
Synonyms

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3)Cl
InChI=1SC23H18ClN3O3Sc12291912915(1317(19)24)21(28)2723(31)251610714(81116)222618534620(18)3022h313H2H21H3(H225272831)
MFCD02820904
N((4(13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)3CHLORO4ETHOXYBENZAMIDE
ZINC000002983598
ZINC02983598
ZINC2983598

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Available files

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