Vitas-M small molecule compound
2-{[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}-1-(4-nitrophenyl)ethanone
Catalog ID
STK558018
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])CSc1ncnc2c1sc1c2c2CC(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 C26H25N5O5S2 MW 551.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O5S2/c1-26(2)11-17-18(12-36-26)23(30-7-9-35-10-8-30)29-24-20(17)21-22(38-24)25(28-14-27-21)37-13-19(32)15-3-5-16(6-4-15)31(33)34/h3-6,14H,7-13H2,1-2H3InChIKey
GNXTUWPEJZZRTM-UHFFFAOYSA-NSynonyms
2((22dimethyl5(morpholin4yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)1(4nitrophenyl)ethanone
2((22dimethyl5morpholino24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)1(4nitrophenyl)ethanone
CC1(CC2=C3C4=C(C(=NC=N4)SCC(=O)C5=CC=C(C=C5)(N+)(=O)(O))SC3=NC(=C2CO1)N6CCOCC6)C
InChI=1SC26H25N5O5S2c126(2)111718(123626)23(30793510830)292420(17)2122(3824)25(28142721)371319(32)153516(6415)31(33)34h3614H713H212H3
MFCD04029396
O=C(c1ccc(cc1)(N+)(=O)(O))CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
ZINC000053319508
ZINC53319508
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