Vitas-M small molecule compound

(1R,2S)-2-({2-[4-oxo-4-(phenylamino)butanoyl]hydrazinyl}carbonyl)cyclohexanecarboxylic acid

Catalog ID
STK017745
SMILES O=C(NNC(=O)[C@H]1CCCC[C@H]1C(=O)O)CCC(=O)Nc1ccccc1

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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 C18H23N3O5 MW 361.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O5/c22-15(19-12-6-2-1-3-7-12)10-11-16(23)20-21-17(24)13-8-4-5-9-14(13)18(25)26/h1-3,6-7,13-14H,4-5,8-11H2,(H,19,22)(H,20,23)(H,21,24)(H,25,26)/t13-,14+/m0/s1
InChIKey
JFYGFUCQEDGLCQ-UONOGXRCSA-N
Synonyms

(1R2S)2(((4ANILINO4OXOBUTANOYL)AMINO)CARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
(1R2S)2((2(4OXO4(PHENYLAMINO)BUTANOYL)HYDRAZINYL)CARBONYL)CYCLOHEXANECARBOXYLICACID
C1CCC(C(C1)C(=O)NNC(=O)CCC(=O)NC2=CC=CC=C2)C(=O)O
InChI=1SC18H23N3O5c2215(19126213712)101116(23)202117(24)13845914(13)18(25)26h13671314H45811H2(H1922)(H2023)(H2124)(H2526)t1314+m0s1
MFCD13368287
O=C(NNC(=O)(C@H)1CCCC(C@H)1C(=O)O)CCC(=O)Nc1ccccc1
STK017745
ZINC000002135273
ZINC2135273

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Available files

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