Vitas-M small molecule compound
(4-benzylpiperazin-1-yl)(4-nitrophenyl)methanethione
Catalog ID
STL436444
SMILES S=C(c1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)Cc1ccccc1
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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 C18H19N3O2S MW 341.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O2S/c22-21(23)17-8-6-16(7-9-17)18(24)20-12-10-19(11-13-20)14-15-4-2-1-3-5-15/h1-9H,10-14H2InChIKey
WKKYZXNLDOUGHY-UHFFFAOYSA-NSynonyms
(4benzylpiperazin1yl)(4nitrophenyl)methanethione
1BENZYL4((4NITROPHENYL)CARBONOTHIOYL)PIPERAZINE
C1CN(CCN1CC2=CC=CC=C2)C(=S)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC18H19N3O2Sc2221(23)178616(7917)18(24)20121019(111320)14154213515h19H1014H2
MFCD04534579
S=C(c1ccc(cc1)(N+)(=O)(O))N1CCN(CC1)Cc1ccccc1
ZINC000019842146
ZINC19842146
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