Vitas-M small molecule compound

1-(4-methylphenyl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethanone

Catalog ID
STK124564
SMILES CCCn1c2ccccc2c2c1nc(SCC(=O)c1ccc(cc1)C)nn2

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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 C21H20N4OS MW 376.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4OS/c1-3-12-25-17-7-5-4-6-16(17)19-20(25)22-21(24-23-19)27-13-18(26)15-10-8-14(2)9-11-15/h4-11H,3,12-13H2,1-2H3
InChIKey
VGMUDKUYIMFLTD-UHFFFAOYSA-N
Synonyms
433256-88-3
1(4METHYLPHENYL)2((5PROPYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ETHANONE
1(4METHYLPHENYL)2((5PROPYL5H(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ETHANONE
433256883
CCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)C4=CC=C(C=C4)C
InChI=1SC21H20N4OSc13122517754616(17)1920(25)2221(242319)271318(26)1510814(2)91115h411H31213H212H3
MFCD03145756
ZINC000002751075
ZINC02751075
ZINC2751075

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Available files

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