Vitas-M small molecule compound

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

Catalog ID
STK013991
SMILES COc1cc(ccc1OC)C(=O)NC(=S)Nc1ccc(cc1)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 C23H19N3O4S MW 433.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O4S/c1-28-19-12-9-15(13-20(19)29-2)21(27)26-23(31)24-16-10-7-14(8-11-16)22-25-17-5-3-4-6-18(17)30-22/h3-13H,1-2H3,(H2,24,26,27,31)
InChIKey
XQPLCUCZJLKJTG-UHFFFAOYSA-N
Synonyms
335213-96-2
1(4BENZOOXAZOL2YLPHENYL)3(34DIMETHOXYBENZOYL)THIOUREA
335213962
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3)OC
COc1cc(ccc1OC)C(=O)NC(=S)Nc1ccc(cc1)c1nc2c(o1)cccc2
InChI=1SC23H19N3O4Sc1281912915(1320(19)292)21(27)2623(31)241610714(81116)222517534618(17)3022h313H12H3(H224262731)
MFCD02577970
N((4(13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)34DIMETHOXYBENZAMIDE
N((4(benzo(d)oxazol2yl)phenyl)carbamothioyl)34dimethoxybenzamide
N(4(13BENZOXAZOL2YL)PHENYL)N(34DIMETHOXYBENZOYL)THIOUREA
STK013991
ZINC000006162706
ZINC06162706
ZINC6162706

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Available files

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