Vitas-M small molecule compound
2,2-dimethyl-5-(2-methylpropyl)-8-[(4-nitrobenzyl)sulfanyl]-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Catalog ID
STL035110
SMILES CC(Cc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCc1ccc(cc1)[N+](=O)[O-])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 C25H26N4O3S2 MW 494.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O3S2/c1-14(2)9-19-18-11-32-25(3,4)10-17(18)20-21-22(34-23(20)28-19)24(27-13-26-21)33-12-15-5-7-16(8-6-15)29(30)31/h5-8,13-14H,9-12H2,1-4H3InChIKey
FDYWZZOQNPJXHH-UHFFFAOYSA-NSynonyms
714936-90-022dimethyl5(2methylpropyl)8((4nitrobenzyl)sulfanyl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidine
5isobutyl22dimethyl8((4nitrobenzyl)thio)24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidine
714936900
CC(C)CC1=C2COC(CC2=C3C4=C(C(=NC=N4)SCC5=CC=C(C=C5)(N+)(=O)(O))SC3=N1)(C)C
CC(Cc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCc1ccc(cc1)(N+)(=O)(O))C
InChI=1SC25H26N4O3S2c114(2)91918113225(34)1017(18)202122(3423(20)2819)24(27132621)3312155716(8615)29(30)31h581314H912H214H3
MFCD04189865
ZINC000001898578
ZINC01898578
ZINC1898578
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