Vitas-M small molecule compound

1-chloro-3-methyl-2-pentylpyrido[1,2-a]benzimidazole-4-carbonitrile

Catalog ID
STK101363
SMILES CCCCCc1c(C)c(C#N)c2n(c1Cl)c1ccccc1n2

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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 C18H18ClN3 MW 311.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3/c1-3-4-5-8-13-12(2)14(11-20)18-21-15-9-6-7-10-16(15)22(18)17(13)19/h6-7,9-10H,3-5,8H2,1-2H3
InChIKey
IDCQVOJVJUWHGK-UHFFFAOYSA-N
Synonyms
518018-37-6
1CHLORO3METHYL2PENTYLBENZO(45)IMIDAZO(12A)PYRIDINE4CARBONITRILE
1CHLORO3METHYL2PENTYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
4CHLORO2METHYL3PENTYL5HYDROPYRIDINO(12A)BENZIMIDAZOLECARBONITRILE
518018376
CCCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)Cl
InChI=1SC18H18ClN3c134581312(2)14(1120)1821159671016(15)22(18)17(13)19h67910H358H212H3
MFCD02668921
ZINC000012648710
ZINC12648710

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Available files

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