Vitas-M small molecule compound
3-hydroxy-3-(3-nitrophenyl)-1-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium
Catalog ID
STK997610
SMILES [O-][N+](=O)c1cccc(c1)C1(O)C[N+](=C2N1CCCS2)c1ccccc1
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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 C18H18N3O3S MW 356.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N3O3S/c22-18(14-6-4-9-16(12-14)21(23)24)13-19(15-7-2-1-3-8-15)17-20(18)10-5-11-25-17/h1-4,6-9,12,22H,5,10-11,13H2/q+1InChIKey
IVUNOEOGWUEBRN-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cccc(c1)C1(O)C(N+)(=C2N1CCCS2)c1ccccc1
3(3nitrophenyl)1phenyl2567tetrahydroimidazo(21b)(13)thiazin4ium3ol
3(3NITROPHENYL)1PHENYL5H6H7H2IMIDAZOLINO(21B)13THIAZAPERHYDROIN3OL
3hydroxy3(3nitrophenyl)1phenyl2367tetrahydro5Himidazo(21b)(13)thiazin1ium
C1C(N+)2=C(N(CC2(C3=CC(=CC=C3)(N+)(=O)(O))O)C4=CC=CC=C4)SC1
InChI=1SC18H18N3O3Sc2218(1464916(1214)21(23)24)1319(157213815)1720(18)105112517h14691222H5101113H2q+1
MFCD02935716
ZINC000013809782
ZINC000013809783
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