Vitas-M small molecule compound
1-(4-chlorophenyl)-2-{[5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}ethanone
Catalog ID
STK532587
SMILES Clc1ccc(cc1)C(=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 C25H23ClN4O2S2 MW 511.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN4O2S2/c26-16-7-5-15(6-8-16)19(31)13-33-25-22-21(27-14-28-25)20-17-3-1-2-4-18(17)23(29-24(20)34-22)30-9-11-32-12-10-30/h5-8,14H,1-4,9-13H2InChIKey
JJQGURGQMCHLJR-UHFFFAOYSA-NSynonyms
1(4chlorophenyl)2((5(morpholin4yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)ethanone
1(4chlorophenyl)2((5morpholino1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)ethanone
C1CCC2=C(N=C3C(=C2C1)C4=C(S3)C(=NC=N4)SCC(=O)C5=CC=C(C=C5)Cl)N6CCOCC6
InChI=1SC25H23ClN4O2S2c26167515(6816)19(31)1333252221(27142825)2017312418(17)23(2924(20)3422)3091132121030h5814H14913H2
MFCD02991290
ZINC000019851339
ZINC19851339
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