Vitas-M small molecule compound
methyl 4-{(1E)-2-cyano-3-oxo-3-[(thiophen-2-ylmethyl)amino]prop-1-en-1-yl}benzoate
Catalog ID
STK102440
SMILES N#C/C(=C\c1ccc(cc1)C(=O)OC)/C(=O)NCc1cccs1
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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 C17H14N2O3S MW 326.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O3S/c1-22-17(21)13-6-4-12(5-7-13)9-14(10-18)16(20)19-11-15-3-2-8-23-15/h2-9H,11H2,1H3,(H,19,20)/b14-9+InChIKey
KSMREOKNCDBLDJ-NTEUORMPSA-NSynonyms
COC(=O)C1=CC=C(C=C1)C=C(C#N)C(=O)NCC2=CC=CS2
InChI=1SC17H14N2O3Sc12217(21)136412(5713)914(1018)16(20)1911153282315h29H11H21H3(H1920)b149+
METHYL4((1E)2CYANO3OXO3((THIOPHEN2YLMETHYL)AMINO)PROP1EN1YL)BENZOATE
METHYL4((E)2CYANO3OXO3(THIOPHEN2YLMETHYLAMINO)PROP1ENYL)BENZOATE
MFCD02195448
N#CC(=Cc1ccc(cc1)C(=O)OC)C(=O)NCc1cccs1
ZINC000004679614
ZINC04679614
ZINC4679614
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