Vitas-M small molecule compound
N'-[9-(benzylsulfanyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]-N,N-diethylethane-1,2-diamine
Catalog ID
STK721739
SMILES CCN(CCNc1nc(SCc2ccccc2)nc2c1sc1c2c2CCCc2c(n1)c1ccccc1)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 C31H33N5S2 MW 539.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N5S2/c1-3-36(4-2)19-18-32-29-28-27(34-31(35-29)37-20-21-12-7-5-8-13-21)25-23-16-11-17-24(23)26(33-30(25)38-28)22-14-9-6-10-15-22/h5-10,12-15H,3-4,11,16-20H2,1-2H3,(H,32,34,35)InChIKey
CUHNEWZTDYOZBW-UHFFFAOYSA-NSynonyms
840485-04-3840485043
CCN(CC)CCNC1=NC(=NC2=C1SC3=NC(=C4CCCC4=C23)C5=CC=CC=C5)SCC6=CC=CC=C6
InChI=1SC31H33N5S2c1336(42)191832292827(3431(3529)372021127581321)252316111724(23)26(3330(25)3828)221496101522h5101215H34111620H212H3(H323435)
MFCD04007533
N(9(benzylsulfanyl)4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)NNdiethylethane12diamine
N1(9(benzylthio)4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)N2N2diethylethane12diamine
ZINC000002264875
ZINC2264875
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