Vitas-M small molecule compound

8-benzyl-1-[(2-chlorobenzyl)sulfanyl]-4-ethyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one

Catalog ID
STL004475
SMILES CCn1c(=O)c2c3CCN(Cc3sc2n2c1nnc2SCc1ccccc1Cl)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 C26H24ClN5OS2 MW 522.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN5OS2/c1-2-31-23(33)22-19-12-13-30(14-17-8-4-3-5-9-17)15-21(19)35-24(22)32-25(31)28-29-26(32)34-16-18-10-6-7-11-20(18)27/h3-11H,2,12-16H2,1H3
InChIKey
RXMRZPGMJPMTTG-UHFFFAOYSA-N
Synonyms
844830-74-6
844830746
8benzyl1((2chlorobenzyl)sulfanyl)4ethyl6789tetrahydropyrido(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
8benzyl1((2chlorobenzyl)thio)4ethyl6789tetrahydropyrido(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CCN1C(=O)C2=C(N3C1=NN=C3SCC4=CC=CC=C4Cl)SC5=C2CCN(C5)CC6=CC=CC=C6
InChI=1SC26H24ClN5OS2c123123(33)2219121330(14178435917)1521(19)3524(22)3225(31)282926(32)34161810671120(18)27h311H21216H21H3
MFCD04161836
ZINC000020310294
ZINC20310294

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Available files

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