Vitas-M small molecule compound
1-{3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl}piperidine
Catalog ID
STK076963
SMILES [O-][N+](=O)c1ccc(cc1Sc1nncn1C)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 C14H17N5O2S MW 319.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N5O2S/c1-17-10-15-16-14(17)22-13-9-11(5-6-12(13)19(20)21)18-7-3-2-4-8-18/h5-6,9-10H,2-4,7-8H2,1H3InChIKey
KHQUNLWVDQABPL-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1Sc1nncn1C)N1CCCCC1
1(3((4METHYL124TRIAZOL3YL)SULFANYL)4NITROPHENYL)PIPERIDINE
1(3((4METHYL4H124TRIAZOL3YL)SULFANYL)4NITROPHENYL)PIPERIDINE
1(3((4methyl4H124triazol3yl)thio)4nitrophenyl)piperidine
2(4METHYL(124TRIAZOL3YLTHIO))1NITRO4PIPERIDYLBENZENE
CN1C=NN=C1SC2=C(C=CC(=C2)N3CCCCC3)(N+)(=O)(O)
InChI=1SC14H17N5O2Sc11710151614(17)2213911(5612(13)19(20)21)187324818h56910H2478H21H3
MFCD01072888
STK076963
ZINC000004117400
ZINC04117400
ZINC4117400
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