Vitas-M small molecule compound

tert-butyl {[4-(1,3-dihydro-2H-benzimidazol-2-ylidenecarbamoyl)cyclohexyl]methyl}carbamate

Catalog ID
STK638179
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 C20H28N4O3 MW 372.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N4O3/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/h4-7,13-14H,8-12H2,1-3H3,(H,21,26)(H2,22,23,24,25)
InChIKey
UBBRDCGRQQNRQZ-UHFFFAOYSA-N
Synonyms
1212227-46-7
(4(1HBENZOIMIDAZOL2YLCARBAMOYL)
(4(1HBENZOIMIDAZOL2YLCARBAMOYL)CYCLOHEXYLMETHYL)CARBAMICACIDTERTBUTYLESTER
1212227467
CC(C)(C)OC(=O)NCC1CCC(CC1)C(=O)NC2=NC3=CC=CC=C3N2
InChI=1SC20H28N4O3c120(23)2719(26)21121381014(11913)17(25)24182215645716(15)2318h471314H812H213H3(H2126)(H222232425)
MFCD18161611
O=C(C1CCC(CC1)CNC(=O)OC(C)(C)C)N=c1(nH)c2c((nH)1)cccc2
tertbutyl((4(13dihydro2Hbenzimidazol2ylidenecarbamoyl)cyclohexyl)methyl)carbamate
tertbutylN((4(1Hbenzimidazol2ylcarbamoyl)cyclohexyl)methyl)carbamate
ZINC000013734030
ZINC100181421
ZINC13734030

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Available files

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