Vitas-M small molecule compound

1-(butylsulfanyl)-3-propylpyrido[1,2-a]benzimidazole-4-carbonitrile

Catalog ID
STK953539
SMILES CCCCSc1cc(CCC)c(c2n1c1ccccc1n2)C#N

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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 C19H21N3S MW 323.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3S/c1-3-5-11-23-18-12-14(8-4-2)15(13-20)19-21-16-9-6-7-10-17(16)22(18)19/h6-7,9-10,12H,3-5,8,11H2,1-2H3
InChIKey
FKNAQDAIKJSSQI-UHFFFAOYSA-N
Synonyms
849011-49-0
1(butylsulfanyl)3propylpyrido(12a)benzimidazole4carbonitrile
1BUTYLSULFANYL3PROPYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
4BUTYLTHIO2PROPYL5HYDROPYRIDINO(12A)BENZIMIDAZOLECARBONITRILE
849011490
CCCCSC1=CC(=C(C2=NC3=CC=CC=C3N12)C#N)CCC
InChI=1SC19H21N3Sc1351123181214(842)15(1320)1921169671017(16)22(18)19h6791012H35811H212H3
MFCD05680621
ZINC000012648913
ZINC12648913

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Available files

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