Vitas-M small molecule compound

7-benzyl-9-methyl-3-(prop-2-en-1-yl)thieno[2,3-d:4,5-d']dipyrimidin-4(3H)-one

Catalog ID
STK644007
SMILES C=CCn1cnc2c(c1=O)sc1c2c(C)nc(n1)Cc1ccccc1

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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 C19H16N4OS MW 348.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4OS/c1-3-9-23-11-20-16-15-12(2)21-14(10-13-7-5-4-6-8-13)22-18(15)25-17(16)19(23)24/h3-8,11H,1,9-10H2,2H3
InChIKey
NWGUCKMIAWTPBF-UHFFFAOYSA-N
Synonyms
1010933-91-1
1010933911
3allyl7benzyl9methylthieno(23d45d)dipyrimidin4(3H)one
7benzyl9methyl3(prop2en1yl)thieno(23d45d)dipyrimidin4(3H)one
CC1=C2C3=C(C(=O)N(C=N3)CC=C)SC2=NC(=N1)CC4=CC=CC=C4
InChI=1SC19H16N4OSc139231120161512(2)2114(10137546813)2218(15)2517(16)19(23)24h3811H1910H22H3
MFCD12200857
ZINC000012389102
ZINC12389102

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Available files

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