Vitas-M small molecule compound
2,2,5-trimethyl-9-(4-nitrobenzyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one
Catalog ID
STK622062
SMILES [O-][N+](=O)c1ccc(cc1)Cn1cnc2c(c1=O)sc1c2c2CC(C)(C)OCc2c(n1)C
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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 C22H20N4O4S MW 436.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O4S/c1-12-16-10-30-22(2,3)8-15(16)17-18-19(31-20(17)24-12)21(27)25(11-23-18)9-13-4-6-14(7-5-13)26(28)29/h4-7,11H,8-10H2,1-3H3InChIKey
KZCNDEAINDRLMD-UHFFFAOYSA-NSynonyms
929967-38-4(O)(N+)(=O)c1ccc(cc1)Cn1cnc2c(c1=O)sc1c2c2CC(C)(C)OCc2c(n1)C
225trimethyl9(4nitrobenzyl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8(9H)one
225trimethyl9(4nitrobenzyl)49dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8(2H)one
929967384
CC1=C2COC(CC2=C3C4=C(C(=O)N(C=N4)CC5=CC=C(C=C5)(N+)(=O)(O))SC3=N1)(C)C
InChI=1SC22H20N4O4Sc11216103022(23)815(16)171819(3120(17)2412)21(27)25(112318)9134614(7513)26(28)29h4711H810H213H3
MFCD09794608
ZINC000008993178
ZINC08993178
ZINC8993178
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