Vitas-M small molecule compound
[4-(2-methyl-4-nitrophenyl)piperazin-1-yl](thiophen-2-yl)methanone
Catalog ID
STK171993
SMILES Cc1cc(ccc1N1CCN(CC1)C(=O)c1cccs1)[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 C16H17N3O3S MW 331.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O3S/c1-12-11-13(19(21)22)4-5-14(12)17-6-8-18(9-7-17)16(20)15-3-2-10-23-15/h2-5,10-11H,6-9H2,1H3InChIKey
JRWTZPDMKSVQNW-UHFFFAOYSA-NSynonyms
(4(2METHYL4NITROPHENYL)PIPERAZIN1YL)(THIOPHEN2YL)METHANONE
(4(2METHYL4NITROPHENYL)PIPERAZIN1YL)THIOPHEN2YLMETHANONE
CC1=C(C=CC(=C1)(N+)(=O)(O))N2CCN(CC2)C(=O)C3=CC=CS3
Cc1cc(ccc1N1CCN(CC1)C(=O)c1cccs1)(N+)(=O)(O)
InChI=1SC16H17N3O3Sc1121113(19(21)22)4514(12)176818(9717)16(20)1532102315h251011H69H21H3
MFCD02624839
ZINC000004703657
ZINC04703657
ZINC4703657
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