Vitas-M small molecule compound
ethyl {[2,2-dimethyl-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]sulfanyl}(phenyl)acetate
Catalog ID
STK531705
SMILES CCOC(=O)C(c1ccccc1)Sc1ncnc2c1sc1c2c2CC(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 C28H30N4O4S2 MW 550.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O4S2/c1-4-35-27(33)22(17-8-6-5-7-9-17)37-26-23-21(29-16-30-26)20-18-14-28(2,3)36-15-19(18)24(31-25(20)38-23)32-10-12-34-13-11-32/h5-9,16,22H,4,10-15H2,1-3H3InChIKey
AMRSEIYAOIUAIL-UHFFFAOYSA-NSynonyms
CCOC(=O)C(C1=CC=CC=C1)SC2=NC=NC3=C2SC4=NC(=C5COC(CC5=C34)(C)C)N6CCOCC6
ethyl((22dimethyl5(morpholin4yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)(phenyl)acetate
ethyl2((22dimethyl5morpholino24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)2phenylacetate
InChI=1SC28H30N4O4S2c143527(33)22(178657917)37262321(29163026)20181428(23)361519(18)24(3125(20)3823)32101234131132h591622H41015H213H3
MFCD02234625
ZINC000001273139
ZINC000001273140
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