Vitas-M small molecule compound
7-benzyl-2-[5-(2-nitrophenyl)furan-2-yl]-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK384768
SMILES OC1=NC(Nc2c1c1CCN(Cc1s2)Cc1ccccc1)c1ccc(o1)c1ccccc1[N+](=O)[O-]
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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 C26H22N4O4S MW 486.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O4S/c31-25-23-18-12-13-29(14-16-6-2-1-3-7-16)15-22(18)35-26(23)28-24(27-25)21-11-10-20(34-21)17-8-4-5-9-19(17)30(32)33/h1-11,24,28H,12-15H2,(H,27,31)InChIKey
NVIBFNLWYGNDJI-UHFFFAOYSA-NSynonyms
7benzyl2(5(2nitrophenyl)furan2yl)123568hexahydropyrido(23)thieno(24d)pyrimidin4one
7benzyl2(5(2nitrophenyl)furan2yl)125678hexahydropyrido(4345)thieno(23d)pyrimidin4ol
C1CN(CC2=C1C3=C(S2)NC(NC3=O)C4=CC=C(O4)C5=CC=CC=C5(N+)(=O)(O))CC6=CC=CC=C6
InChI=1SC26H22N4O4Sc31252318121329(14166213716)1522(18)3526(23)2824(2725)21111020(3421)17845919(17)30(32)33h1112428H1215H2(H2731)
MFCD05661727
OC1=NC(Nc2c1c1CCN(Cc1s2)Cc1ccccc1)c1ccc(o1)c1ccccc1(N+)(=O)(O)
ZINC000015947382
ZINC000015947384
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