Vitas-M small molecule compound

N,N-dibutyl-2-{[5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}acetamide

Catalog ID
STK539106
SMILES CCCCN(C(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)CCCC

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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 C27H37N5O2S2 MW 527.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H37N5O2S2/c1-3-5-11-31(12-6-4-2)21(33)17-35-27-24-23(28-18-29-27)22-19-9-7-8-10-20(19)25(30-26(22)36-24)32-13-15-34-16-14-32/h18H,3-17H2,1-2H3
InChIKey
MBJMKOUOHRLTRW-UHFFFAOYSA-N
Synonyms
370574-61-1
370574611
CCCCN(CCCC)C(=O)CSC1=NC=NC2=C1SC3=NC(=C4CCCCC4=C23)N5CCOCC5
InChI=1SC27H37N5O2S2c1351131(12642)21(33)1735272423(28182927)22199781020(19)25(3026(22)3624)32131534161432h18H317H212H3
MFCD03011119
NNdibutyl2((5(morpholin4yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)acetamide
NNdibutyl2((5morpholino1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)acetamide
ZINC000020057418
ZINC20057418

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Available files

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