Vitas-M small molecule compound

N-[2-(propan-2-yl)-1H-benzimidazol-6-yl]-1-(1H-tetrazol-1-yl)cyclohexanecarboxamide

Catalog ID
STL250690
SMILES O=C(C1(CCCCC1)n1cnnn1)Nc1ccc2c(c1)[nH]c(n2)C(C)C

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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 C18H23N7O MW 353.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N7O/c1-12(2)16-21-14-7-6-13(10-15(14)22-16)20-17(26)18(8-4-3-5-9-18)25-11-19-23-24-25/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,20,26)(H,21,22)
InChIKey
XMZMNIFKFHYGSN-UHFFFAOYSA-N
Synonyms
1401557-41-2
1401557412
CC(C)C1=NC2=C(N1)C=C(C=C2)NC(=O)C3(CCCCC3)N4C=NN=N4
InChI=1SC18H23N7Oc112(2)1621147613(1015(14)2216)2017(26)18(8435918)251119232425h671012H3589H212H3(H2026)(H2122)
MFCD24852432
N(2(propan2yl)1Hbenzimidazol6yl)1(1Htetrazol1yl)cyclohexanecarboxamide
N(2isopropyl1Hbenzo(d)imidazol5yl)1(1Htetrazol1yl)cyclohexanecarboxamide
N(2propan2yl3Hbenzimidazol5yl)1(tetrazol1yl)cyclohexane1carboxamide
O=C(C1(CCCCC1)n1cnnn1)Nc1ccc2c(c1)(nH)c(n2)C(C)C
O=C(C1(CCCCC1)n1cnnn1)Nc1ccc2c(c1)nc((nH)2)C(C)C
ZINC000079501549
ZINC79501549

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Available files

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