Vitas-M small molecule compound
7-ethyl-2-(5-hydroxy-2-nitrophenyl)-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK384592
SMILES CCN1CCc2c(C1)sc1c2C(=NC(N1)c1cc(O)ccc1[N+](=O)[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 C17H18N4O4S MW 374.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O4S/c1-2-20-6-5-10-13(8-20)26-17-14(10)16(23)18-15(19-17)11-7-9(22)3-4-12(11)21(24)25/h3-4,7,15,19,22H,2,5-6,8H2,1H3,(H,18,23)InChIKey
SVVGNZYPGCJDLE-UHFFFAOYSA-NSynonyms
7ethyl2(5hydroxy2nitrophenyl)123568hexahydropyrido(23)thieno(24d)pyrimidin4one
7ethyl2(5hydroxy2nitrophenyl)125678hexahydropyrido(4345)thieno(23d)pyrimidin4ol
CCN1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=C(C=CC(=C4)O)(N+)(=O)(O)
CCN1CCc2c(C1)sc1c2C(=NC(N1)c1cc(O)ccc1(N+)(=O)(O))O
InChI=1SC17H18N4O4Sc1220651013(820)261714(10)16(23)1815(1917)1179(22)3412(11)21(24)25h347151922H2568H21H3(H1823)
MFCD05661633
ZINC000006594375
ZINC000006594381
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