Vitas-M small molecule compound
2-phenylethyl 4-({[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}amino)-4-oxobutanoate
Catalog ID
STK948039
SMILES O=C(NC(=S)Nc1ccc(cc1)S(=O)(=O)NC(=N)N)CCC(=O)OCCc1ccccc1
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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 C20H23N5O5S2 MW 477.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O5S2/c21-19(22)25-32(28,29)16-8-6-15(7-9-16)23-20(31)24-17(26)10-11-18(27)30-13-12-14-4-2-1-3-5-14/h1-9H,10-13H2,(H4,21,22,25)(H2,23,24,26,31)InChIKey
VWSUVQLLZNTQCE-UHFFFAOYSA-NSynonyms
2phenylethyl4(((4(carbamimidoylsulfamoyl)phenyl)carbamothioyl)amino)4oxobutanoate
2phenylethyl4((4(diaminomethylideneamino)sulfonylphenyl)carbamothioylamino)4oxobutanoate
C1=CC=C(C=C1)CCOC(=O)CCC(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N
InChI=1SC20H23N5O5S2c2119(22)2532(2829)168615(7916)2320(31)2417(26)101118(27)301312144213514h19H1013H2(H4212225)(H223242631)
MFCD05880211
PHENETHYL4((4(DIAMINOMETHYLIDENEAMINO)SULFONYLPHENYL)CARBAMOTHIOYLAMINO)4OXOBUTANOATE
ZINC000020283365
ZINC20283365
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