Vitas-M small molecule compound
2-{[5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}-N,N-diphenylacetamide
Catalog ID
STK721392
SMILES CC(Cc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC(=O)N(c1ccccc1)c1ccccc1)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 C31H30N4OS2 MW 538.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4OS2/c1-20(2)17-25-23-15-9-10-16-24(23)27-28-29(38-30(27)34-25)31(33-19-32-28)37-18-26(36)35(21-11-5-3-6-12-21)22-13-7-4-8-14-22/h3-8,11-14,19-20H,9-10,15-18H2,1-2H3InChIKey
HFUNLEGEQXJLNE-UHFFFAOYSA-NSynonyms
385388-20-52((5(2methylpropyl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)NNdiphenylacetamide
2((5isobutyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)NNdiphenylacetamide
385388205
CC(C)CC1=C2CCCCC2=C3C4=C(C(=NC=N4)SCC(=O)N(C5=CC=CC=C5)C6=CC=CC=C6)SC3=N1
InChI=1SC31H30N4OS2c120(2)172523159101624(23)272829(3830(27)3425)31(33193228)371826(36)35(21115361221)22137481422h3811141920H9101518H212H3
MFCD03285552
ZINC000001807716
ZINC01807716
ZINC1807716
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