Vitas-M small molecule compound
2-{4-[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]piperazin-1-yl}ethanol
Catalog ID
STL304441
SMILES OCCN1CCN(CC1)c1nc(SC)nc2c1sc1c2c2CC(C)(C)OCc2c(n1)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 C25H34N6O3S2 MW 530.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H34N6O3S2/c1-25(2)14-16-17(15-34-25)21(31-9-12-33-13-10-31)27-23-18(16)19-20(36-23)22(28-24(26-19)35-3)30-6-4-29(5-7-30)8-11-32/h32H,4-15H2,1-3H3InChIKey
QRUWNBOTCXJTPZ-UHFFFAOYSA-NSynonyms
844836-52-82(4(22dimethyl10(methylsulfanyl)5(morpholin4yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)piperazin1yl)ethanol
2(4(22dimethyl10(methylthio)5morpholino24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)piperazin1yl)ethanol
844836528
CC1(CC2=C3C4=C(C(=NC(=N4)SC)N5CCN(CC5)CCO)SC3=NC(=C2CO1)N6CCOCC6)C
InChI=1SC25H34N6O3S2c125(2)141617(153425)21(3191233131031)272318(16)1920(3623)22(2824(2619)353)306429(5730)81132h32H415H213H3
MFCD04164133
ZINC000020358402
ZINC20358402
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