2-chloranyl-N-(4-fluorophenyl)-N-prop-2-enyl-5-[(pyrimidin-2-ylamino)carbamoyl]benzenesulfonamide

Systemtic Name: 2-chloranyl-N-(4-fluorophenyl)-N-prop-2-enyl-5-[(pyrimidin-2-ylamino)carbamoyl]benzenesulfonamide Openeye Name: N-allyl-2-chloro-N-(4-fluorophenyl)-5-[(pyrimidin-2-ylamino)carbamoyl]benzenesulfonamide CAS Name: 2-chloro-N-(4-fluorophenyl)-5-[oxo-(2-pyrimidinylhydrazo)methyl]-N-prop-2-enylbenzenesulfonamide IUPAC Name: 2-chloro-N-(4-fluorophenyl)-N-prop-2-enyl-5-[(pyrimidin-2-ylamino)carbamoyl]benzenesulfonamide Traditional Name: N-allyl-2-chloro-N-(4-fluorophenyl)-5-[(2-pyrimidylamino)carbamoyl]benzenesulfonamide Formula: C20H17ClFN5O3S MolecularWeight: 461.897083

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=CC=C(C=C1)F)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NNC3=NC=CC=N3)Cl

Isomeric SMILES

C=CCN(C1=CC=C(C=C1)F)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NNC3=NC=CC=N3)Cl

InChI

InChI=1S/C20H17ClFN5O3S/c1-2-12-27(16-7-5-15(22)6-8-16)31(29,30)18-13-14(4-9-17(18)21)19(28)25-26-20-23-10-3-11-24-20/h2-11,13H,1,12H2,(H,25,28)(H,23,24,26)