N-[4-[(4-methyl-6-phenylazanyl-pyrimidin-2-yl)amino]phenyl]naphthalene-2-sulfonamide

Systemtic Name: N-[4-[(4-methyl-6-phenylazanyl-pyrimidin-2-yl)amino]phenyl]naphthalene-2-sulfonamide Openeye Name: N-[4-[(4-anilino-6-methyl-pyrimidin-2-yl)amino]phenyl]naphthalene-2-sulfonamide CAS Name: N-[4-[(4-anilino-6-methyl-2-pyrimidinyl)amino]phenyl]-2-naphthalenesulfonamide IUPAC Name: N-[4-[(4-anilino-6-methylpyrimidin-2-yl)amino]phenyl]naphthalene-2-sulfonamide Traditional Name: N-[4-[(4-anilino-6-methyl-pyrimidin-2-yl)amino]phenyl]naphthalene-2-sulfonamide Formula: C27H23N5O2S MolecularWeight: 481.56882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)NC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)NC5=CC=CC=C5

InChI

InChI=1S/C27H23N5O2S/c1-19-17-26(29-22-9-3-2-4-10-22)31-27(28-19)30-23-12-14-24(15-13-23)32-35(33,34)25-16-11-20-7-5-6-8-21(20)18-25/h2-18,32H,1H3,(H2,28,29,30,31)