Vitas-M small molecule compound
[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl](thiophen-2-yl)methanone
Catalog ID
STK355353
SMILES COc1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)C(=O)c1cccs1
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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 C16H17N3O4S MW 347.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O4S/c1-23-12-4-5-13(14(11-12)19(21)22)17-6-8-18(9-7-17)16(20)15-3-2-10-24-15/h2-5,10-11H,6-9H2,1H3InChIKey
KLFWBBXBVSAJDN-UHFFFAOYSA-NSynonyms
(4(4methoxy2nitrophenyl)piperazin1yl)(thiophen2yl)methanone
(4(4METHOXY2NITROPHENYL)PIPERAZIN1YL)THIOPHEN2YLMETHANONE
COC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CS3)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))N1CCN(CC1)C(=O)c1cccs1
InChI=1SC16H17N3O4Sc123124513(14(1112)19(21)22)176818(9717)16(20)1532102415h251011H69H21H3
MFCD05829321
ZINC000004748580
ZINC04748580
ZINC4748580
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