N-[(3-aminophenyl)methyl]-N-[3-(2-azanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)propyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(3-aminophenyl)methyl]-N-[3-(2-azanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)propyl]-4-methyl-benzenesulfonamide Openeye Name: N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]-N-[(3-aminophenyl)methyl]-4-methyl-benzenesulfonamide CAS Name: N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]-N-[(3-aminophenyl)methyl]-4-methylbenzenesulfonamide IUPAC Name: N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]-N-[(3-aminophenyl)methyl]-4-methylbenzenesulfonamide Traditional Name: N-(3-aminobenzyl)-N-[3-(2-amino-4-keto-6-methyl-1H-pyrimidin-5-yl)propyl]-4-methyl-benzenesulfonamide Formula: C22H27N5O3S MolecularWeight: 441.54648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCCC2=C(NC(=NC2=O)N)C)CC3=CC(=CC=C3)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCCC2=C(NC(=NC2=O)N)C)CC3=CC(=CC=C3)N

InChI

InChI=1S/C22H27N5O3S/c1-15-8-10-19(11-9-15)31(29,30)27(14-17-5-3-6-18(23)13-17)12-4-7-20-16(2)25-22(24)26-21(20)28/h3,5-6,8-11,13H,4,7,12,14,23H2,1-2H3,(H3,24,25,26,28)