Vitas-M small molecule compound

N-(2,6-dimethylphenyl)-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide

Catalog ID
STK697462
SMILES CCCn1c2ccccc2c2c1nc(SCC(=O)Nc1c(C)cccc1C)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 C22H23N5OS MW 405.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5OS/c1-4-12-27-17-11-6-5-10-16(17)20-21(27)24-22(26-25-20)29-13-18(28)23-19-14(2)8-7-9-15(19)3/h5-11H,4,12-13H2,1-3H3,(H,23,28)
InChIKey
GYEAEOJNBVPEKM-UHFFFAOYSA-N
Synonyms

CCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NC4=C(C=CC=C4C)C
InChI=1SC22H23N5OSc1412271711651016(17)2021(27)2422(262520)291318(28)231914(2)87915(19)3h511H41213H213H3(H2328)
MFCD01797894
N(26DIMETHYLPHENYL)2((5PROPYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETAMIDE
N(26dimethylphenyl)2((5propyl5H(124)triazino(56b)indol3yl)sulfanyl)acetamide
ZINC000000720787
ZINC00720787
ZINC720787

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Available files

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