5-(3-azanyl-4-methyl-phenyl)-2-ethyl-4-hexyl-1,2,4-triazol-3-one

Systemtic Name: 5-(3-azanyl-4-methyl-phenyl)-2-ethyl-4-hexyl-1,2,4-triazol-3-one Openeye Name: 5-(3-amino-4-methyl-phenyl)-2-ethyl-4-hexyl-1,2,4-triazol-3-one CAS Name: 5-(3-amino-4-methylphenyl)-2-ethyl-4-hexyl-1,2,4-triazol-3-one IUPAC Name: 5-(3-amino-4-methylphenyl)-2-ethyl-4-hexyl-1,2,4-triazol-3-one Traditional Name: 5-(3-amino-4-methyl-phenyl)-2-ethyl-4-hexyl-1,2,4-triazol-3-one Formula: C17H26N4O MolecularWeight: 302.41454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=NN(C1=O)CC)C2=CC(=C(C=C2)C)N

Isomeric SMILES

CCCCCCN1C(=NN(C1=O)CC)C2=CC(=C(C=C2)C)N

InChI

InChI=1S/C17H26N4O/c1-4-6-7-8-11-20-16(19-21(5-2)17(20)22)14-10-9-13(3)15(18)12-14/h9-10,12H,4-8,11,18H2,1-3H3