Vitas-M small molecule compound

N-(2-chlorophenyl)-2-[(11-propyl-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)sulfanyl]acetamide

Catalog ID
STK553104
SMILES CCCc1nc2sc3c(c2c2c1CCCC2)ncn1c3nnc1SCC(=O)Nc1ccccc1Cl

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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 C25H23ClN6OS2 MW 523.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN6OS2/c1-2-7-17-14-8-3-4-9-15(14)20-21-22(35-24(20)29-17)23-30-31-25(32(23)13-27-21)34-12-19(33)28-18-11-6-5-10-16(18)26/h5-6,10-11,13H,2-4,7-9,12H2,1H3,(H,28,33)
InChIKey
LUZGQRFAJCOYNL-UHFFFAOYSA-N
Synonyms
836652-55-2
836652552
CCCC1=C2CCCCC2=C3C4=C(C5=NN=C(N5C=N4)SCC(=O)NC6=CC=CC=C6Cl)SC3=N1
InChI=1SC25H23ClN6OS2c1271714834915(14)202122(3524(20)2917)23303125(32(23)132721)341219(33)281811651016(18)26h56101113H247912H21H3(H2833)
MFCD03692546
N(2chlorophenyl)2((11propyl78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinolin3yl)sulfanyl)acetamide
N(2chlorophenyl)2((11propyl78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinolin3yl)thio)acetamide
ZINC000008744279
ZINC08744279
ZINC8744279

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Available files

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