Vitas-M small molecule compound

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

Catalog ID
STK018786
SMILES CCc1ccc2c(c1)nc(o2)c1ccc(cc1)NC(=S)NC(=O)c1ccc(cc1)C

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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 C24H21N3O2S MW 415.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O2S/c1-3-16-6-13-21-20(14-16)26-23(29-21)18-9-11-19(12-10-18)25-24(30)27-22(28)17-7-4-15(2)5-8-17/h4-14H,3H2,1-2H3,(H2,25,27,28,30)
InChIKey
CRHBPTHSUHXNRQ-UHFFFAOYSA-N
Synonyms

CCC1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=C(C=C4)C
CCc1ccc2c(c1)nc(o2)c1ccc(cc1)NC(=S)NC(=O)c1ccc(cc1)C
InChI=1SC24H21N3O2Sc13166132120(1416)2623(2921)1891119(121018)2524(30)2722(28)177415(2)5817h414H3H212H3(H225272830)
MFCD02625349
N((4(5ETHYL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)4METHYLBENZAMIDE
STK018786
ZINC000002979773
ZINC02979773
ZINC2979773

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Available files

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