4-azanyl-N-[2-(azetidin-2-yl)-6-(methylamino)pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 4-azanyl-N-[2-(azetidin-2-yl)-6-(methylamino)pyrimidin-4-yl]benzenesulfonamide Openeye Name: 4-amino-N-[2-(azetidin-2-yl)-6-(methylamino)pyrimidin-4-yl]benzenesulfonamide CAS Name: 4-amino-N-[2-(2-azetidinyl)-6-(methylamino)-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-amino-N-[2-(azetidin-2-yl)-6-(methylamino)pyrimidin-4-yl]benzenesulfonamide Traditional Name: 4-amino-N-[2-(azetidin-2-yl)-6-(methylamino)pyrimidin-4-yl]benzenesulfonamide Formula: C14H18N6O2S MolecularWeight: 334.39672

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC(=NC(=N1)C2CCN2)NS(=O)(=O)C3=CC=C(C=C3)N

Isomeric SMILES

CNC1=CC(=NC(=N1)C2CCN2)NS(=O)(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C14H18N6O2S/c1-16-12-8-13(19-14(18-12)11-6-7-17-11)20-23(21,22)10-4-2-9(15)3-5-10/h2-5,8,11,17H,6-7,15H2,1H3,(H2,16,18,19,20)