Vitas-M small molecule compound
1,1'-{[2,2-dimethyl-10-(methylsulfanyl)-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]imino}dipropan-2-ol
Catalog ID
STL304432
SMILES CSc1nc(N(CC(O)C)CC(O)C)c2c(n1)c1c(s2)nc(c2c1CC(C)(C)OC2)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 C25H35N5O4S2 MW 533.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H35N5O4S2/c1-14(31)11-30(12-15(2)32)22-20-19(26-24(28-22)35-5)18-16-10-25(3,4)34-13-17(16)21(27-23(18)36-20)29-6-8-33-9-7-29/h14-15,31-32H,6-13H2,1-5H3InChIKey
YDNLICYBAKGKQJ-UHFFFAOYSA-NSynonyms
848205-69-611((22dimethyl10(methylsulfanyl)5(morpholin4yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)imino)dipropan2ol
11((22dimethyl10(methylthio)5morpholino24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)azanediyl)bis(propan2ol)
848205696
CC(CN(CC(C)O)C1=NC(=NC2=C1SC3=NC(=C4COC(CC4=C23)(C)C)N5CCOCC5)SC)O
InChI=1SC25H35N5O4S2c114(31)1130(1215(2)32)222019(2624(2822)355)18161025(34)341317(16)21(2723(18)3620)2968339729h14153132H613H215H3
MFCD04188034
ZINC000013778371
ZINC000020439265
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