N-[3-[4-(pyridin-3-ylmethylamino)quinazolin-2-yl]phenyl]methanesulfonamide

Systemtic Name: N-[3-[4-(pyridin-3-ylmethylamino)quinazolin-2-yl]phenyl]methanesulfonamide Openeye Name: N-[3-[4-(3-pyridylmethylamino)quinazolin-2-yl]phenyl]methanesulfonamide CAS Name: N-[3-[4-(3-pyridinylmethylamino)-2-quinazolinyl]phenyl]methanesulfonamide IUPAC Name: N-[3-[4-(pyridin-3-ylmethylamino)quinazolin-2-yl]phenyl]methanesulfonamide Traditional Name: N-[3-[4-(3-pyridylmethylamino)quinazolin-2-yl]phenyl]methanesulfonamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=N2)NCC4=CN=CC=C4

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=N2)NCC4=CN=CC=C4

InChI

InChI=1S/C21H19N5O2S/c1-29(27,28)26-17-8-4-7-16(12-17)20-24-19-10-3-2-9-18(19)21(25-20)23-14-15-6-5-11-22-13-15/h2-13,26H,14H2,1H3,(H,23,24,25)