Vitas-M small molecule compound

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

Catalog ID
STK180535
SMILES CCOc1ccc(cc1)c1oc2c(n1)cc(cc2)NC(=S)NC(=O)c1ccccc1C

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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 C24H21N3O3S MW 431.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O3S/c1-3-29-18-11-8-16(9-12-18)23-26-20-14-17(10-13-21(20)30-23)25-24(31)27-22(28)19-7-5-4-6-15(19)2/h4-14H,3H2,1-2H3,(H2,25,27,28,31)
InChIKey
ZCPFWSNGQVJDBR-UHFFFAOYSA-N
Synonyms

CCOC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC=CC=C4C
InChI=1SC24H21N3O3Sc13291811816(91218)2326201417(101321(20)3023)2524(31)2722(28)19754615(19)2h414H3H212H3(H225272831)
MFCD02811201
N((2(4ETHOXYPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)2METHYLBENZAMIDE
ZINC000001170075
ZINC01170075
ZINC1170075

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Available files

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