Vitas-M small molecule compound

3,6-diamino-N-(4-bromophenyl)-5-cyano-4-[4-(propan-2-yl)phenyl]thieno[2,3-b]pyridine-2-carboxamide

Catalog ID
STK841539
SMILES N#Cc1c(N)nc2c(c1c1ccc(cc1)C(C)C)c(N)c(s2)C(=O)Nc1ccc(cc1)Br

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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 C24H20BrN5OS MW 506.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20BrN5OS/c1-12(2)13-3-5-14(6-4-13)18-17(11-26)22(28)30-24-19(18)20(27)21(32-24)23(31)29-16-9-7-15(25)8-10-16/h3-10,12H,27H2,1-2H3,(H2,28,30)(H,29,31)
InChIKey
OBMMGDPLDAUCBT-UHFFFAOYSA-N
Synonyms
361478-02-6
361478026
36diaminoN(4bromophenyl)5cyano4(4(propan2yl)phenyl)thieno(23b)pyridine2carboxamide
36DIAMINON(4BROMOPHENYL)5CYANO4(4ISOPROPYLPHENYL)THIENO(23B)PYRIDINE2CARBOXAMIDE
36DIAMINON(4BROMOPHENYL)5CYANO4(4PROPAN2YLPHENYL)THIENO(23B)PYRIDINE2CARBOXAMIDE
CC(C)C1=CC=C(C=C1)C2=C(C(=NC3=C2C(=C(S3)C(=O)NC4=CC=C(C=C4)Br)N)N)C#N
InChI=1SC24H20BrN5OSc112(2)133514(6413)1817(1126)22(28)302419(18)20(27)21(3224)23(31)29169715(25)81016h31012H27H212H3(H22830)(H2931)
MFCD03304705
ZINC000020130958
ZINC20130958

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Available files

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