Vitas-M small molecule compound

N-{[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-1,3-benzodioxole-5-carboxamide

Catalog ID
STK520465
SMILES S=C(NC(=O)c1ccc2c(c1)OCO2)Nc1ccc2c(c1)nc(o2)c1ccc(cc1)Cl

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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 C22H14ClN3O4S MW 451.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14ClN3O4S/c23-14-4-1-12(2-5-14)21-25-16-10-15(6-8-17(16)30-21)24-22(31)26-20(27)13-3-7-18-19(9-13)29-11-28-18/h1-10H,11H2,(H2,24,26,27,31)
InChIKey
DSQZPFMYRTWFGR-UHFFFAOYSA-N
Synonyms

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=N4)C5=CC=C(C=C5)Cl
InChI=1SC22H14ClN3O4Sc23144112(2514)2125161015(6817(16)3021)2422(31)2620(27)13371819(913)29112818h110H11H2(H224262731)
MFCD08727645
N((2(4chlorophenyl)13benzoxazol5yl)carbamothioyl)13benzodioxole5carboxamide
ZINC000012651280
ZINC12651280

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Available files

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