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CHEBI:116965 - 2-[(3-methyl-4-oxo-5H-pyrimido[5,4-b]indol-2-yl)thio]-N-(4-methylphenyl)acetamide

ChEBI IDCHEBI:116965
ChEBI Name2-[(3-methyl-4-oxo-5H-pyrimido[5,4-b]indol-2-yl)thio]-N-(4-methylphenyl)acetamide
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Last Modified6 March 2020
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FormulaC20H18N4O2S
Net Charge0
Average Mass378.457
Monoisotopic Mass378.11505
SMILESCc1ccc(NC(=O)CSc2nc3c(nc4ccccc43)c(=O)n2C)cc1
InChIInChI=1S/C20H18N4O2S/c1-12-7-9-13(10-8-12)21-16(25)11-27-20-23-17-14-5-3-4-6-15(14)22-18(17)19(26)24(20)2/h3-10,22H,11H2,1-2H3,(H,21,25)
InChIKeyTUWKZBRJNSSHKT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(3-methyl-4-oxo-5H-pyrimido[5,4-b]indol-2-yl)thio]-N-(4-methylphenyl)acetamide (CHEBI:116965) is a pyrimido-indole (CHEBI:146266)
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LSM-28413LINCS