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CHEBI:43213 - N-(2-ISOPROPYLPHENYL)-3-[(2-THIENYLMETHYL)THIO]-1H-1,2,4-TRIAZOL-5-AMINE

Default Structure
ChEBI IDCHEBI:43213
ChEBI NameN-(2-ISOPROPYLPHENYL)-3-[(2-THIENYLMETHYL)THIO]-1H-1,2,4-TRIAZOL-5-AMINE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC16H18N4S2
Net Charge0
Average Mass330.482
Monoisotopic Mass330.09729
SMILES[H]c1sc(C([H])([H])Sc2nc(N([H])c3c([H])c([H])c([H])c([H])c3C([H])(C([H])([H])[H])C([H])([H])[H])n([H])n2)c([H])c1[H]
InChIInChI=1S/C16H18N4S2/c1-11(2)13-7-3-4-8-14(13)17-15-18-16(20-19-15)22-10-12-6-5-9-21-12/h3-9,11H,10H2,1-2H3,(H2,17,18,19,20)
InChIKeyQMNSHLAPQLBIGP-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(2-ISOPROPYLPHENYL)-3-[(2-THIENYLMETHYL)THIO]-1H-1,2,4-TRIAZOL-5-AMINE (CHEBI:43213) is a unclassifieds (CHEBI:27189)
Synonyms  Source
N-[2-(1-methylethyl)phenyl]-3-[(thiophen-2-ylmethyl)sulfanyl]-1H-1,2,4-triazol-5-aminePDBeChem
N-(2-ISOPROPYLPHENYL)-3-[(2-THIENYLMETHYL)THIO]-1H-1,2,4-TRIAZOL-5-AMINEPDBeChem
Manual XrefsDatabases
I96PDBeChem