Vitas-M small molecule compound
(4-ethylpiperazin-1-yl)(4-nitrophenyl)methanethione
Catalog ID
STL436433
SMILES CCN1CCN(CC1)C(=S)c1ccc(cc1)[N+](=O)[O-]
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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 C13H17N3O2S MW 279.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3O2S/c1-2-14-7-9-15(10-8-14)13(19)11-3-5-12(6-4-11)16(17)18/h3-6H,2,7-10H2,1H3InChIKey
OBXBYWMIZVRLAE-UHFFFAOYSA-NSynonyms
(4ethylpiperazin1yl)(4nitrophenyl)methanethione
1ETHYL4((4NITROPHENYL)CARBONOTHIOYL)PIPERAZINE
CCN1CCN(CC1)C(=S)c1ccc(cc1)(N+)(=O)(O)
CCN1CCN(CC1)C(=S)C2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC13H17N3O2Sc12147915(10814)13(19)113512(6411)16(17)18h36H2710H21H3
MFCD03995608
ZINC000055526427
ZINC55526427
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