Vitas-M small molecule compound
2-{[4-(4-nitrophenyl)-1,3-thiazol-2-yl]carbamoyl}cyclohexanecarboxylic acid
Catalog ID
STK418965
SMILES O=C(C1CCCCC1C(=O)O)Nc1scc(n1)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 C17H17N3O5S MW 375.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O5S/c21-15(12-3-1-2-4-13(12)16(22)23)19-17-18-14(9-26-17)10-5-7-11(8-6-10)20(24)25/h5-9,12-13H,1-4H2,(H,22,23)(H,18,19,21)InChIKey
PISKCPPVSBLPFQ-UHFFFAOYSA-NSynonyms
352679-43-72((4(4NITROPHENYL)13THIAZOL2YL)CARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
2((4(4nitrophenyl)13thiazol2yl)carbamoyl)cyclohexanecarboxylicacid
352679437
C1CCC(C(C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)(N+)(=O)(O))C(=O)O
InChI=1SC17H17N3O5Sc2115(12312413(12)16(22)23)19171814(92617)105711(8610)20(24)25h591213H14H2(H2223)(H181921)
MFCD01340492
O=C(C1CCCCC1C(=O)O)Nc1scc(n1)c1ccc(cc1)(N+)(=O)(O)
ZINC000002737114
ZINC000002737117
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