Vitas-M small molecule compound

N-{[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3-methoxynaphthalene-2-carboxamide

Catalog ID
STK184543
SMILES COc1cc2ccccc2cc1C(=O)NC(=S)Nc1ccc2c(c1)nn(n2)c1ccc(cc1)F

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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 C25H18FN5O2S MW 471.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18FN5O2S/c1-33-23-13-16-5-3-2-4-15(16)12-20(23)24(32)28-25(34)27-18-8-11-21-22(14-18)30-31(29-21)19-9-6-17(26)7-10-19/h2-14H,1H3,(H2,27,28,32,34)
InChIKey
IDTMXJHZDWKIQV-UHFFFAOYSA-N
Synonyms

COC1=CC2=CC=CC=C2C=C1C(=O)NC(=S)NC3=CC4=NN(N=C4C=C3)C5=CC=C(C=C5)F
InChI=1SC25H18FN5O2Sc133231316532415(16)1220(23)24(32)2825(34)27188112122(1418)3031(2921)199617(26)71019h214H1H3(H227283234)
MFCD03306987
N((2(4FLUOROPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)3METHOXYNAPHTHALENE2CARBOXAMIDE
N((2(4FLUOROPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)3METHOXYNAPHTHALENE2CARBOXAMIDE
ZINC000001181565
ZINC01181565
ZINC1181565

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Available files

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