Vitas-M small molecule compound
2-(4-nitrophenyl)-3-thioxo-2,3,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-1(5H)-one
Catalog ID
STL177427
SMILES S=C1N2Cc3ccccc3CC2C(=O)N1c1ccc(cc1)[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 C17H13N3O3S MW 339.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O3S/c21-16-15-9-11-3-1-2-4-12(11)10-18(15)17(24)19(16)13-5-7-14(8-6-13)20(22)23/h1-8,15H,9-10H2InChIKey
YSWFCMAVFGVKBD-UHFFFAOYSA-NSynonyms
2(4nitrophenyl)3sulfanylidene1010adihydro5Himidazo(15b)isoquinolin1one
2(4nitrophenyl)3thioxo231010atetrahydroimidazo(15b)isoquinolin1(5H)one
C1C2C(=O)N(C(=S)N2CC3=CC=CC=C31)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC17H13N3O3Sc211615911312412(11)1018(15)17(24)19(16)135714(8613)20(22)23h1815H910H2
MFCD04129599
S=C1N2Cc3ccccc3CC2C(=O)N1c1ccc(cc1)(N+)(=O)(O)
ZINC000003911281
ZINC000003911282
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