Vitas-M small molecule compound

N-{[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-3-methoxybenzamide

Catalog ID
STK048729
SMILES COc1cccc(c1)C(=O)NC(=S)Nc1ccc(cc1)c1oc2c(n1)cc(c(c2)C)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 C24H21N3O3S MW 431.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O3S/c1-14-11-20-21(12-15(14)2)30-23(26-20)16-7-9-18(10-8-16)25-24(31)27-22(28)17-5-4-6-19(13-17)29-3/h4-13H,1-3H3,(H2,25,27,28,31)
InChIKey
VUCFYXBUUXBLMU-UHFFFAOYSA-N
Synonyms

CC1=CC2=C(C=C1C)OC(=N2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC(=CC=C4)OC
COc1cccc(c1)C(=O)NC(=S)Nc1ccc(cc1)c1oc2c(n1)cc(c(c2)C)C
InChI=1SC24H21N3O3Sc114112021(1215(14)2)3023(2620)167918(10816)2524(31)2722(28)1754619(1317)293h413H13H3(H225272831)
MFCD02631479
N((4(56DIMETHYL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)3METHOXYBENZAMIDE
STK048729
ZINC000001173241
ZINC01173241
ZINC1173241

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Available files

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