Vitas-M small molecule compound
1-{(1E)-2-cyano-3-oxo-3-[(2-phenylethyl)amino]prop-1-en-1-yl}piperidine-4-carboxylic acid
Catalog ID
STK715958
SMILES N#C/C(=C\N1CCC(CC1)C(=O)O)/C(=O)NCCc1ccccc1
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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 C18H21N3O3 MW 327.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O3/c19-12-16(13-21-10-7-15(8-11-21)18(23)24)17(22)20-9-6-14-4-2-1-3-5-14/h1-5,13,15H,6-11H2,(H,20,22)(H,23,24)/b16-13+InChIKey
ZJWJUNKXMVLIGU-DTQAZKPQSA-NSynonyms
885181-28-2(E)1(2cyano3oxo3(phenethylamino)prop1en1yl)piperidine4carboxylicacid
1((1E)2cyano3oxo3((2phenylethyl)amino)prop1en1yl)piperidine4carboxylicacid
1((E)2cyano3oxo3(2phenylethylamino)prop1enyl)piperidine4carboxylicacid
885181282
C1CN(CCC1C(=O)O)C=C(C#N)C(=O)NCCC2=CC=CC=C2
InChI=1SC18H21N3O3c191216(132110715(81121)18(23)24)17(22)2096144213514h151315H611H2(H2022)(H2324)b1613+
MFCD07642565
N#CC(=CN1CCC(CC1)C(=O)O)C(=O)NCCc1ccccc1
ZINC000030791194
ZINC30791194
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