Vitas-M small molecule compound

methyl [(4-cyano-3-propylpyrido[1,2-a]benzimidazol-1-yl)sulfanyl]acetate

Catalog ID
STK953533
SMILES CCCc1cc(SCC(=O)OC)n2c(c1C#N)nc1c2cccc1

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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 C18H17N3O2S MW 339.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O2S/c1-3-6-12-9-16(24-11-17(22)23-2)21-15-8-5-4-7-14(15)20-18(21)13(12)10-19/h4-5,7-9H,3,6,11H2,1-2H3
InChIKey
CXMJXWUXOMWKHR-UHFFFAOYSA-N
Synonyms
848990-58-9
848990589
CCCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)OC)C#N
InChI=1SC18H17N3O2Sc13612916(241117(22)232)2115854714(15)2018(21)13(12)1019h4579H3611H212H3
methyl((4cyano3propylpyrido(12a)benzimidazol1yl)sulfanyl)acetate
METHYL2((4CYANO3PROPYLBENZO(45)IMIDAZO(12A)PYRIDIN1YL)THIO)ACETATE
METHYL2(4CYANO3PROPYL10HYDROPYRIDINO(16A)BENZIMIDAZOLYLTHIO)ACETATE
METHYL2(4CYANO3PROPYLPYRIDO(12A)BENZIMIDAZOL1YL)SULFANYLACETATE
MFCD05678965
ZINC000002446748
ZINC02446748
ZINC2446748

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Available files

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