CHEBI:113214 - 1-[2-[(4-pentoxyphenyl)methylthio]ethyl]-3-phenylthiourea

ChEBI IDCHEBI:113214
ChEBI Name1-[2-[(4-pentoxyphenyl)methylthio]ethyl]-3-phenylthiourea
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FormulaC21H28N2OS2
Net Charge0
Average Mass388.602
Monoisotopic Mass388.16431
SMILESCCCCCOc1ccc(CSCCNC(=S)Nc2ccccc2)cc1
InChIInChI=1S/C21H28N2OS2/c1-2-3-7-15-24-20-12-10-18(11-13-20)17-26-16-14-22-21(25)23-19-8-5-4-6-9-19/h4-6,8-13H,2-3,7,14-17H2,1H3,(H2,22,23,25)
InChIKeyHNLHVUNAGKSCKK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[2-[(4-pentoxyphenyl)methylthio]ethyl]-3-phenylthiourea (CHEBI:113214) is a thioureas (CHEBI:51276)
Manual XrefsDatabases
LSM-24625LINCS