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CHEBI:120487 - 2-cyano-3-[1-methyl-5-(4-methylphenyl)-2-pyrrolyl]-2-propenethioamide

ChEBI IDCHEBI:120487
ChEBI Name2-cyano-3-[1-methyl-5-(4-methylphenyl)-2-pyrrolyl]-2-propenethioamide
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DownloadsMolfile
FormulaC16H15N3S
Net Charge0
Average Mass281.384
Monoisotopic Mass281.09867
SMILESCc1ccc(-c2ccc(C=C(C#N)C(N)=S)n2C)cc1
InChIInChI=1S/C16H15N3S/c1-11-3-5-12(6-4-11)15-8-7-14(19(15)2)9-13(10-17)16(18)20/h3-9H,1-2H3,(H2,18,20)
InChIKeyIRQWOJMMSKLDJQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-cyano-3-[1-methyl-5-(4-methylphenyl)-2-pyrrolyl]-2-propenethioamide (CHEBI:120487) is a pyrroles (CHEBI:26455)
Manual XrefsDatabases
LSM-31930LINCS