Vitas-M small molecule compound
N-(3,4-dichlorophenyl)-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
STK541085
SMILES O=C(Nc1ccc(c(c1)Cl)Cl)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 C25H23Cl2N5O2S2 MW 560.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23Cl2N5O2S2/c26-17-6-5-14(11-18(17)27)30-19(33)12-35-25-22-21(28-13-29-25)20-15-3-1-2-4-16(15)23(31-24(20)36-22)32-7-9-34-10-8-32/h5-6,11,13H,1-4,7-10,12H2,(H,30,33)InChIKey
OOFYORSKQGMGEP-UHFFFAOYSA-NSynonyms
C1CCC2=C(N=C3C(=C2C1)C4=C(S3)C(=NC=N4)SCC(=O)NC5=CC(=C(C=C5)Cl)Cl)N6CCOCC6
InChI=1SC25H23Cl2N5O2S2c26176514(1118(17)27)3019(33)1235252221(28132925)2015312416(15)23(3124(20)3622)32793410832h561113H1471012H2(H3033)
MFCD03011364
N(34dichlorophenyl)2((5(morpholin4yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)acetamide
N(34dichlorophenyl)2((5morpholino1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)acetamide
ZINC000053292279
ZINC53292279
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