Vitas-M small molecule compound

tert-butyl [4-(1,3-dihydro-2H-benzimidazol-2-ylidenecarbamoyl)benzyl]carbamate

Catalog ID
STK647125
SMILES O=C(c1ccc(cc1)CNC(=O)OC(C)(C)C)/N=c/1\[nH]c2c([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 C20H22N4O3 MW 366.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O3/c1-20(2,3)27-19(26)21-12-13-8-10-14(11-9-13)17(25)24-18-22-15-6-4-5-7-16(15)23-18/h4-11H,12H2,1-3H3,(H,21,26)(H2,22,23,24,25)
InChIKey
HAXPGVHJYAYIOB-UHFFFAOYSA-N
Synonyms
951985-34-5
951985345
CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)NC2=NC3=CC=CC=C3N2
InChI=1SC20H22N4O3c120(23)2719(26)21121381014(11913)17(25)24182215645716(15)2318h411H12H213H3(H2126)(H222232425)
MFCD18164462
tertbutyl(4(13dihydro2Hbenzimidazol2ylidenecarbamoyl)benzyl)carbamate
tertbutylN((4(1Hbenzimidazol2ylcarbamoyl)phenyl)methyl)carbamate
ZINC000013690092
ZINC13690092

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Available files

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