Vitas-M small molecule compound

N-benzyl-2-(6-oxo-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-7(6H)-yl)acetamide

Catalog ID
STK593165
SMILES O=C(Cn1c2ccccc2c2c1c(=O)n1CCCSc1n2)NCc1ccccc1

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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 C22H20N4O2S MW 404.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O2S/c27-18(23-13-15-7-2-1-3-8-15)14-26-17-10-5-4-9-16(17)19-20(26)21(28)25-11-6-12-29-22(25)24-19/h1-5,7-10H,6,11-14H2,(H,23,27)
InChIKey
VIBGFZBEVPQMSB-UHFFFAOYSA-N
Synonyms
904210-17-9
904210179
C1CN2C(=O)C3=C(C4=CC=CC=C4N3CC(=O)NCC5=CC=CC=C5)N=C2SC1
InChI=1SC22H20N4O2Sc2718(2313157213815)1426171054916(17)1920(26)21(28)25116122922(25)2419h15710H61114H2(H2327)
MFCD07641172
Nbenzyl2(6oxo34dihydro2H(13)thiazino(3212)pyrimido(54b)indol7(6H)yl)acetamide
ZINC000005451777
ZINC05451777
ZINC5451777

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Available files

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