Vitas-M small molecule compound

N-{[4-chloro-3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-1-benzofuran-2-carboxamide

Catalog ID
STK079919
SMILES CCc1ccc2c(c1)nc(o2)c1cc(ccc1Cl)NC(=S)NC(=O)c1cc2c(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 C25H18ClN3O3S MW 475.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClN3O3S/c1-2-14-7-10-21-19(11-14)28-24(32-21)17-13-16(8-9-18(17)26)27-25(33)29-23(30)22-12-15-5-3-4-6-20(15)31-22/h3-13H,2H2,1H3,(H2,27,29,30,33)
InChIKey
SOXFJRVOKJWTMR-UHFFFAOYSA-N
Synonyms
364601-69-4
364601694
CCC1=CC2=C(C=C1)OC(=N2)C3=C(C=CC(=C3)NC(=S)NC(=O)C4=CC5=CC=CC=C5O4)Cl
CCc1ccc2c(c1)nc(o2)c1cc(ccc1Cl)NC(=S)NC(=O)c1cc2c(o1)cccc2
InChI=1SC25H18ClN3O3Sc12147102119(1114)2824(3221)171316(8918(17)26)2725(33)2923(30)221215534620(15)3122h313H2H21H3(H227293033)
MFCD02920903
N((4CHLORO3(5ETHYL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)1BENZOFURAN2CARBOXAMIDE
N((4chloro3(5ethylbenzo(d)oxazol2yl)phenyl)carbamothioyl)benzofuran2carboxamide
STK079919
ZINC000002453663
ZINC02453663
ZINC2453663

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Available files

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