CHEBI:93718 - 4-[[4-(2-methoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]-1-butanol

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ChEBI Name 4-[[4-(2-methoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]-1-butanol
ChEBI ID CHEBI:93718
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C18H26N6O2
Net Charge 0
Average Mass 358.439
Monoisotopic Mass 358.21172
InChI InChI=1S/C18H26N6O2/c1-26-15-9-3-2-8-14(15)20-17-21-16(19-10-4-7-13-25)22-18(23-17)24-11-5-6-12-24/h2-3,8-9,25H,4-7,10-13H2,1H3,(H2,19,20,21,22,23)
InChIKey XCHYDCJZOYDVEW-UHFFFAOYSA-N
SMILES COC1=CC=CC=C1NC2=NC(=NC(=N2)N3CCCC3)NCCCCO
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 4-[[4-(2-methoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]-1-butanol (CHEBI:93718) is a methoxybenzenes (CHEBI:51683)
4-[[4-(2-methoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]-1-butanol (CHEBI:93718) is a substituted aniline (CHEBI:48975)
Manual Xref Database
LSM-4211 LINCS
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