Vitas-M small molecule compound
N,N-diethyl-N'-[5-(propan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]ethane-1,2-diamine
Catalog ID
STK721286
SMILES CCN(CCNc1ncnc2c1sc1c2c2CCCCc2c(n1)C(C)C)CC
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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 C22H31N5S MW 397.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31N5S/c1-5-27(6-2)12-11-23-21-20-19(24-13-25-21)17-15-9-7-8-10-16(15)18(14(3)4)26-22(17)28-20/h13-14H,5-12H2,1-4H3,(H,23,24,25)InChIKey
JXXDJFQXWVGNHK-UHFFFAOYSA-NSynonyms
CCN(CC)CCNC1=NC=NC2=C1SC3=NC(=C4CCCCC4=C23)C(C)C
InChI=1SC22H31N5Sc1527(62)121123212019(24132521)17159781016(15)18(14(3)4)2622(17)2820h1314H512H214H3(H232425)
MFCD02240350
N1N1diethylN2(5isopropyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)ethane12diamine
NNdiethylN(5(propan2yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)ethane12diamine
ZINC000001305174
ZINC1305174
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