[4-azanyl-6-[(2-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl-bis(furan-2-ylmethyl)azanium

Systemtic Name: [4-azanyl-6-[(2-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl-bis(furan-2-ylmethyl)azanium Openeye Name: [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl-bis(2-furylmethyl)ammonium CAS Name: [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl-bis(2-furanylmethyl)ammonium IUPAC Name: [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl-bis(furan-2-ylmethyl)azanium Traditional Name: [4-amino-6-(o-toluidino)-s-triazin-2-yl]methyl-bis(2-furfuryl)ammonium Formula: C21H23N6O2+ MolecularWeight: 391.44632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)C[NH+](CC3=CC=CO3)CC4=CC=CO4

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)C[NH+](CC3=CC=CO3)CC4=CC=CO4

InChI

InChI=1S/C21H22N6O2/c1-15-6-2-3-9-18(15)23-21-25-19(24-20(22)26-21)14-27(12-16-7-4-10-28-16)13-17-8-5-11-29-17/h2-11H,12-14H2,1H3,(H3,22,23,24,25,26)/p+1