N-[(1R,2S)-2-[(4-azanylquinazolin-2-yl)amino]cyclohexyl]naphthalene-1-sulfonamide

Systemtic Name: N-[(1R,2S)-2-[(4-azanylquinazolin-2-yl)amino]cyclohexyl]naphthalene-1-sulfonamide Openeye Name: N-[(1R,2S)-2-[(4-aminoquinazolin-2-yl)amino]cyclohexyl]naphthalene-1-sulfonamide CAS Name: N-[(1R,2S)-2-[(4-amino-2-quinazolinyl)amino]cyclohexyl]-1-naphthalenesulfonamide IUPAC Name: N-[(1R,2S)-2-[(4-aminoquinazolin-2-yl)amino]cyclohexyl]naphthalene-1-sulfonamide Traditional Name: N-[(1R,2S)-2-[(4-aminoquinazolin-2-yl)amino]cyclohexyl]naphthalene-1-sulfonamide Formula: C24H25N5O2S MolecularWeight: 447.5526

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)NC2=NC3=CC=CC=C3C(=N2)N)NS(=O)(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CC[C@H]([C@H](C1)NC2=NC3=CC=CC=C3C(=N2)N)NS(=O)(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C24H25N5O2S/c25-23-18-11-3-4-12-19(18)26-24(28-23)27-20-13-5-6-14-21(20)29-32(30,31)22-15-7-9-16-8-1-2-10-17(16)22/h1-4,7-12,15,20-21,29H,5-6,13-14H2,(H3,25,26,27,28)/t20-,21+/m0/s1