(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 4-(furan-2-ylmethylsulfamoyl)benzoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 4-(furan-2-ylmethylsulfamoyl)benzoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 4-(2-furylmethylsulfamoyl)benzoate CAS Name: 4-(2-furanylmethylsulfamoyl)benzoic acid (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 4-(furan-2-ylmethylsulfamoyl)benzoate Traditional Name: 4-(2-furfurylsulfamoyl)benzoic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C22H20N6O5S MolecularWeight: 480.4964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CO4

InChI

InChI=1S/C22H20N6O5S/c23-21-26-19(27-22(28-21)25-16-5-2-1-3-6-16)14-33-20(29)15-8-10-18(11-9-15)34(30,31)24-13-17-7-4-12-32-17/h1-12,24H,13-14H2,(H3,23,25,26,27,28)