N-[[4-[[(4-azanylquinazolin-2-yl)amino]methyl]cyclohexyl]methyl]-N-methyl-naphthalene-1-sulfonamide

Systemtic Name: N-[[4-[[(4-azanylquinazolin-2-yl)amino]methyl]cyclohexyl]methyl]-N-methyl-naphthalene-1-sulfonamide Openeye Name: N-[[4-[[(4-aminoquinazolin-2-yl)amino]methyl]cyclohexyl]methyl]-N-methyl-naphthalene-1-sulfonamide CAS Name: N-[[4-[[(4-amino-2-quinazolinyl)amino]methyl]cyclohexyl]methyl]-N-methyl-1-naphthalenesulfonamide IUPAC Name: N-[[4-[[(4-aminoquinazolin-2-yl)amino]methyl]cyclohexyl]methyl]-N-methylnaphthalene-1-sulfonamide Traditional Name: N-[[4-[[(4-aminoquinazolin-2-yl)amino]methyl]cyclohexyl]methyl]-N-methyl-naphthalene-1-sulfonamide Formula: C27H31N5O2S MolecularWeight: 489.63234

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCC(CC1)CNC2=NC3=CC=CC=C3C(=N2)N)S(=O)(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CN(CC1CCC(CC1)CNC2=NC3=CC=CC=C3C(=N2)N)S(=O)(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H31N5O2S/c1-32(35(33,34)25-12-6-8-21-7-2-3-9-22(21)25)18-20-15-13-19(14-16-20)17-29-27-30-24-11-5-4-10-23(24)26(28)31-27/h2-12,19-20H,13-18H2,1H3,(H3,28,29,30,31)