Vitas-M small molecule compound

6-propyl-1-(pyridin-3-ylmethyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one

Catalog ID
STK572119
SMILES CCCN1CNc2c(C1)c(=O)nc(n2Cc1cccnc1)S

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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 C15H19N5OS MW 317.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19N5OS/c1-2-6-19-9-12-13(17-10-19)20(15(22)18-14(12)21)8-11-4-3-5-16-7-11/h3-5,7,17H,2,6,8-10H2,1H3,(H,18,21,22)
InChIKey
QVFXAAIMSMZRNC-UHFFFAOYSA-N
Synonyms
879597-40-7
6propyl1(pyridin3ylmethyl)2sulfanyl5678tetrahydropyrimido(45d)pyrimidin4(1H)one
6propyl1(pyridin3ylmethyl)2sulfanylidene78dihydro5Hpyrimido(45d)pyrimidin4one
879597407
CCCN1CC2=C(NC1)N(C(=S)NC2=O)CC3=CN=CC=C3
InChI=1SC15H19N5OSc1261991213(171019)20(15(22)1814(12)21)81143516711h35717H26810H21H3(H182122)
MFCD07797704
ZINC000020567609
ZINC20567609

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Available files

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