Vitas-M small molecule compound
2,2-dimethyl-5-(2-methylpropyl)-10-(methylsulfanyl)-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
STK721756
SMILES CSc1nc(SCc2ccc(cc2)[N+](=O)[O-])c2c(n1)c1c(s2)nc(c2c1CC(C)(C)OC2)CC(C)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 C26H28N4O3S3 MW 540.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O3S3/c1-14(2)10-19-18-12-33-26(3,4)11-17(18)20-21-22(36-23(20)27-19)24(29-25(28-21)34-5)35-13-15-6-8-16(9-7-15)30(31)32/h6-9,14H,10-13H2,1-5H3InChIKey
RLWSGAAFPOMOCA-UHFFFAOYSA-NSynonyms
714292-17-822dimethyl5(2methylpropyl)10(methylsulfanyl)8((4nitrobenzyl)sulfanyl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidine
5isobutyl22dimethyl10(methylthio)8((4nitrobenzyl)thio)24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidine
714292178
CC(C)CC1=C2COC(CC2=C3C4=C(C(=NC(=N4)SC)SCC5=CC=C(C=C5)(N+)(=O)(O))SC3=N1)(C)C
CSc1nc(SCc2ccc(cc2)(N+)(=O)(O))c2c(n1)c1c(s2)nc(c2c1CC(C)(C)OC2)CC(C)C
InChI=1SC26H28N4O3S3c114(2)101918123326(34)1117(18)202122(3623(20)2719)24(2925(2821)345)3513156816(9715)30(31)32h6914H1013H215H3
MFCD05681079
ZINC000002452883
ZINC2452883
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