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

Systemtic Name: 4-azanyl-N-[2-(azetidin-2-yl)-6-chloranyl-pyrimidin-4-yl]benzenesulfonamide Openeye Name: 4-amino-N-[2-(azetidin-2-yl)-6-chloro-pyrimidin-4-yl]benzenesulfonamide CAS Name: 4-amino-N-[2-(2-azetidinyl)-6-chloro-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-amino-N-[2-(azetidin-2-yl)-6-chloropyrimidin-4-yl]benzenesulfonamide Traditional Name: 4-amino-N-[2-(azetidin-2-yl)-6-chloro-pyrimidin-4-yl]benzenesulfonamide Formula: C13H14ClN5O2S MolecularWeight: 339.80056

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC1C2=NC(=CC(=N2)Cl)NS(=O)(=O)C3=CC=C(C=C3)N

Isomeric SMILES

C1CNC1C2=NC(=CC(=N2)Cl)NS(=O)(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C13H14ClN5O2S/c14-11-7-12(18-13(17-11)10-5-6-16-10)19-22(20,21)9-3-1-8(15)2-4-9/h1-4,7,10,16H,5-6,15H2,(H,17,18,19)