Vitas-M small molecule compound
N-(4-methoxyphenyl)-2-{[5-(propan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}acetamide
Catalog ID
STK721413
SMILES COc1ccc(cc1)NC(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)C(C)C
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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 C25H26N4O2S2 MW 478.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O2S2/c1-14(2)21-18-7-5-4-6-17(18)20-22-23(33-24(20)29-21)25(27-13-26-22)32-12-19(30)28-15-8-10-16(31-3)11-9-15/h8-11,13-14H,4-7,12H2,1-3H3,(H,28,30)InChIKey
HJQLEZTYOKHAJO-UHFFFAOYSA-NSynonyms
370575-19-22((5isopropyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)N(4methoxyphenyl)acetamide
370575192
CC(C)C1=C2CCCCC2=C3C4=C(C(=NC=N4)SCC(=O)NC5=CC=C(C=C5)OC)SC3=N1
InChI=1SC25H26N4O2S2c114(2)2118754617(18)202223(3324(20)2921)25(27132622)321219(30)281581016(313)11915h8111314H4712H213H3(H2830)
MFCD03011168
N(4methoxyphenyl)2((5(propan2yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)acetamide
ZINC000001247132
ZINC01247132
ZINC1247132
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