N-[3-[6-[(phenylmethyl)amino]pyrimidin-4-yl]phenyl]methanesulfonamide

Systemtic Name: N-[3-[6-[(phenylmethyl)amino]pyrimidin-4-yl]phenyl]methanesulfonamide Openeye Name: N-[3-[6-(benzylamino)pyrimidin-4-yl]phenyl]methanesulfonamide CAS Name: N-[3-[6-[(phenylmethyl)amino]-4-pyrimidinyl]phenyl]methanesulfonamide IUPAC Name: N-[3-[6-(benzylamino)pyrimidin-4-yl]phenyl]methanesulfonamide Traditional Name: N-[3-[6-(benzylamino)pyrimidin-4-yl]phenyl]methanesulfonamide Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1)C2=CC(=NC=N2)NCC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1)C2=CC(=NC=N2)NCC3=CC=CC=C3

InChI

InChI=1S/C18H18N4O2S/c1-25(23,24)22-16-9-5-8-15(10-16)17-11-18(21-13-20-17)19-12-14-6-3-2-4-7-14/h2-11,13,22H,12H2,1H3,(H,19,20,21)