Vitas-M small molecule compound

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

Catalog ID
STK174208
SMILES COc1ccc(cc1NC(=S)NC(=O)c1cccc(c1OC)C)c1nc2c(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 C24H21N3O4S MW 447.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O4S/c1-14-7-6-8-16(21(14)30-3)22(28)27-24(32)26-18-13-15(11-12-19(18)29-2)23-25-17-9-4-5-10-20(17)31-23/h4-13H,1-3H3,(H2,26,27,28,32)
InChIKey
UTCKJDZWGCVMQB-UHFFFAOYSA-N
Synonyms

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2=C(C=CC(=C2)C3=NC4=CC=CC=C4O3)OC
InChI=1SC24H21N3O4Sc11476816(21(14)303)22(28)2724(32)26181315(111219(18)292)2325179451020(17)3123h413H13H3(H226272832)
MFCD04096396
N((5(13BENZOXAZOL2YL)2METHOXYPHENYL)CARBAMOTHIOYL)2METHOXY3METHYLBENZAMIDE
ZINC000009892152
ZINC09892152
ZINC9892152

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Available files

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