1-(2,6-diethylphenyl)-4-(ethylamino)-1,3,5-triazin-2-one; methanesulfonic acid

Systemtic Name: 1-(2,6-diethylphenyl)-4-(ethylamino)-1,3,5-triazin-2-one; methanesulfonic acid Openeye Name: 1-(2,6-diethylphenyl)-4-(ethylamino)-1,3,5-triazin-2-one; methanesulfonic acid CAS Name: 1-(2,6-diethylphenyl)-4-(ethylamino)-1,3,5-triazin-2-one; methanesulfonic acid IUPAC Name: 1-(2,6-diethylphenyl)-4-(ethylamino)-1,3,5-triazin-2-one; methanesulfonic acid Traditional Name: 1-(2,6-diethylphenyl)-4-(ethylamino)-s-triazin-2-one; mesylic acid Formula: C16H24N4O4S MolecularWeight: 368.45116

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N2C=NC(=NC2=O)NCC.CS(=O)(=O)O

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N2C=NC(=NC2=O)NCC.CS(=O)(=O)O

InChI

InChI=1S/C15H20N4O.CH4O3S/c1-4-11-8-7-9-12(5-2)13(11)19-10-17-14(16-6-3)18-15(19)20;1-5(2,3)4/h7-10H,4-6H2,1-3H3,(H,16,18,20);1H3,(H,2,3,4)