Vitas-M small molecule compound
1-{4-nitro-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]phenyl}piperidine
Catalog ID
STK037853
SMILES [O-][N+](=O)c1ccc(cc1Sc1nnnn1c1ccccc1)N1CCCCC1
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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 C18H18N6O2S MW 382.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O2S/c25-24(26)16-10-9-15(22-11-5-2-6-12-22)13-17(16)27-18-19-20-21-23(18)14-7-3-1-4-8-14/h1,3-4,7-10,13H,2,5-6,11-12H2InChIKey
QBPSNMNHDRFQHX-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1Sc1nnnn1c1ccccc1)N1CCCCC1
1(4NITRO3((1PHENYL1HTETRAZOL5YL)SULFANYL)PHENYL)PIPERIDINE
1(4NITRO3(1PHENYLTETRAZOL5YL)SULFANYLPHENYL)PIPERIDINE
C1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))SC3=NN=NN3C4=CC=CC=C4
InChI=1SC18H18N6O2Sc2524(26)1610915(22115261222)1317(16)271819202123(18)147314814h13471013H2561112H2
MFCD03306442
STK037853
ZINC000004608213
ZINC04608213
ZINC4608213
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