Vitas-M small molecule compound
methyl 2-({[(2E)-3-(naphthalen-1-yl)prop-2-enoyl]carbamothioyl}amino)benzoate
Catalog ID
STL063290
SMILES COC(=O)c1ccccc1NC(=S)NC(=O)/C=C/c1cccc2c1cccc2
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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 C22H18N2O3S MW 390.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O3S/c1-27-21(26)18-11-4-5-12-19(18)23-22(28)24-20(25)14-13-16-9-6-8-15-7-2-3-10-17(15)16/h2-14H,1H3,(H2,23,24,25,28)/b14-13+InChIKey
GPBMEYQUOFHXAV-BUHFOSPRSA-NSynonyms
COC(=O)C1=CC=CC=C1NC(=S)NC(=O)C=CC2=CC=CC3=CC=CC=C32
COC(=O)c1ccccc1NC(=S)NC(=O)C=Cc1cccc2c1cccc2
InChI=1SC22H18N2O3Sc12721(26)1811451219(18)2322(28)2420(25)141316968157231017(15)16h214H1H3(H223242528)b1413+
methyl2((((2E)3(naphthalen1yl)prop2enoyl)carbamothioyl)amino)benzoate
METHYL2((((3(1NAPHTHYL)ACRYLOYL)AMINO)CARBOTHIOYL)AMINO)BENZOATE
METHYL2(((E)3NAPHTHALEN1YLPROP2ENOYL)CARBAMOTHIOYLAMINO)BENZOATE
MFCD05655256
ZINC000002136514
ZINC02136514
ZINC2136514
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