Vitas-M small molecule compound

N-{[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl}-2-methoxy-3-methylbenzamide

Catalog ID
STK347327
SMILES COc1c(C)cccc1C(=O)NC(=S)Nc1ccc(cc1)c1nc2c([nH]1)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 C23H20N4O2S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O2S/c1-14-6-5-7-17(20(14)29-2)22(28)27-23(30)24-16-12-10-15(11-13-16)21-25-18-8-3-4-9-19(18)26-21/h3-13H,1-2H3,(H,25,26)(H2,24,27,28,30)
InChIKey
WMNXNNDIFODZIH-UHFFFAOYSA-N
Synonyms

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3
COc1c(C)cccc1C(=O)NC(=S)Nc1ccc(cc1)c1nc2c((nH)1)cccc2
InChI=1SC23H20N4O2Sc11465717(20(14)292)22(28)2723(30)2416121015(111316)212518834919(18)2621h313H12H3(H2526)(H224272830)
MFCD05849001
N((4(1Hbenzimidazol2yl)phenyl)carbamothioyl)2methoxy3methylbenzamide
ZINC000002884227
ZINC02884227
ZINC2884227

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Available files

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