Vitas-M small molecule compound
N-(3-chlorophenyl)-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
STK557954
SMILES O=C(Nc1cccc(c1)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 C25H24ClN5O2S2 MW 526.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN5O2S2/c26-15-4-3-5-16(12-15)29-19(32)13-34-25-22-21(27-14-28-25)20-17-6-1-2-7-18(17)23(30-24(20)35-22)31-8-10-33-11-9-31/h3-5,12,14H,1-2,6-11,13H2,(H,29,32)InChIKey
SJLJEZQBMWEFAT-UHFFFAOYSA-NSynonyms
577964-29-5577964295
C1CCC2=C(N=C3C(=C2C1)C4=C(S3)C(=NC=N4)SCC(=O)NC5=CC(=CC=C5)Cl)N6CCOCC6
InChI=1SC25H24ClN5O2S2c261543516(1215)2919(32)1334252221(27142825)2017612718(17)23(3024(20)3522)318103311931h351214H1261113H2(H2932)
MFCD04028889
N(3chlorophenyl)2((5(morpholin4yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)acetamide
N(3chlorophenyl)2((5morpholino1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)acetamide
ZINC000097953975
ZINC97953975
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