Vitas-M small molecule compound

N-(2-methoxyphenyl)-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
STK539733
SMILES COc1ccccc1NC(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

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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 C26H27N5O3S2 MW 521.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O3S2/c1-33-19-9-5-4-8-18(19)29-20(32)14-35-26-23-22(27-15-28-26)21-16-6-2-3-7-17(16)24(30-25(21)36-23)31-10-12-34-13-11-31/h4-5,8-9,15H,2-3,6-7,10-14H2,1H3,(H,29,32)
InChIKey
TUPJSZPYOAFVQN-UHFFFAOYSA-N
Synonyms
385417-08-3
385417083
COC1=CC=CC=C1NC(=O)CSC2=NC=NC3=C2SC4=NC(=C5CCCCC5=C34)N6CCOCC6
InChI=1SC26H27N5O3S2c13319954818(19)2920(32)1435262322(27152826)2116623717(16)24(3025(21)3623)31101234131131h458915H23671014H21H3(H2932)
MFCD03285970
N(2methoxyphenyl)2((5(morpholin4yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)acetamide
N(2methoxyphenyl)2((5morpholino1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)acetamide
ZINC000020057852
ZINC20057852

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Available files

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