Vitas-M small molecule compound
10-nitro-1-phenyl-1,3,6,7-tetrahydro-5H-3,6-epoxy[1,5]oxathionino[8,7,6-cd]indazole
Catalog ID
STK770260
SMILES [O-][N+](=O)c1cc2SCC3COC(c4c2c(c1)n(n4)c1ccccc1)O3
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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 C17H13N3O4S MW 355.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O4S/c21-20(22)11-6-13-15-14(7-11)25-9-12-8-23-17(24-12)16(15)18-19(13)10-4-2-1-3-5-10/h1-7,12,17H,8-9H2InChIKey
HQFIYKYESWWZQR-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc2SCC3COC(c4c2c(c1)n(n4)c1ccccc1)O3
10nitro1phenyl1367tetrahydro5H36epoxy(15)oxathionino(876cd)indazole
C1C2CSC3=C4C(=CC(=C3)(N+)(=O)(O))N(N=C4C(O1)O2)C5=CC=CC=C5
InChI=1SC17H13N3O4Sc2120(22)116131514(711)2591282317(2412)16(15)1819(13)104213510h171217H89H2
MFCD03765918
ZINC000001072705
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