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N-(6,6-dimethyl-2-nonyl-4-oxo-5,8-dihydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(6H)-yl)-2-nitrobenzamide

Catalog ID
STK087910
SMILES CCCCCCCCCc1nc2sc3c(c2c(=O)n1NC(=O)c1ccccc1[N+](=O)[O-])CC(OC3)(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 C27H34N4O5S MW 526.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N4O5S/c1-4-5-6-7-8-9-10-15-22-28-25-23(19-16-27(2,3)36-17-21(19)37-25)26(33)30(22)29-24(32)18-13-11-12-14-20(18)31(34)35/h11-14H,4-10,15-17H2,1-3H3,(H,29,32)
InChIKey
QNJMFIXYSCNJRI-UHFFFAOYSA-N
Synonyms
303959-66-2
303959662
CCCCCCCCCC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N1NC(=O)C4=CC=CC=C4(N+)(=O)(O)
CCCCCCCCCc1nc2sc3c(c2c(=O)n1NC(=O)c1ccccc1(N+)(=O)(O))CC(OC3)(C)C
InChI=1SC27H34N4O5Sc1456789101522282523(191627(23)361721(19)3725)26(33)30(22)2924(32)181311121420(18)31(34)35h1114H4101517H213H3(H2932)
MFCD01854206
N(4KETO66DIMETHYL2NONYL58DIHYDROPYRANO(23)THIENO(24D)PYRIMIDIN3YL)2NITROBENZAMIDE
N(66DIMETHYL2NONYL4OXIDANYLIDENE58DIHYDROPYRANO(23)THIENO(24D)PYRIMIDIN3YL)2NITROBENZAMIDE
N(66dimethyl2nonyl4oxo4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin3yl)2nitrobenzamide
N(66dimethyl2nonyl4oxo58dihydro4Hpyrano(4345)thieno(23d)pyrimidin3(6H)yl)2nitrobenzamide
N(66DIMETHYL2NONYL4OXO58DIHYDROPYRANO(23)THIENO(24D)PYRIMIDIN3YL)2NITROBENZAMIDE
STK087910
ZINC000001822679
ZINC01822679
ZINC1822679

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Available files

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