N-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[5-[(E)-N'-oxidanylcarbamimidoyl]pyridin-2-yl]propanamide

Systemtic Name: N-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[5-[(E)-N'-oxidanylcarbamimidoyl]pyridin-2-yl]propanamide Openeye Name: N-(3-chloro-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[5-[(E)-N'-hydroxycarbamimidoyl]-2-pyridyl]propanamide CAS Name: N-[5-[(E)-amino(hydroxyimino)methyl]-2-pyridinyl]-N-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentylpropanamide IUPAC Name: N-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-[5-[(E)-N'-hydroxycarbamimidoyl]pyridin-2-yl]propanamide Traditional Name: N-[5-[(E)-aminocarbohydroximoyl]-2-pyridyl]-N-(3-chloro-4-mesyl-phenyl)-3-cyclopentyl-propionamide Formula: C21H25ClN4O4S MolecularWeight: 464.9656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)N(C2=NC=C(C=C2)C(=NO)N)C(=O)CCC3CCCC3)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)N(C2=NC=C(C=C2)/C(=N\O)/N)C(=O)CCC3CCCC3)Cl

InChI

InChI=1S/C21H25ClN4O4S/c1-31(29,30)18-9-8-16(12-17(18)22)26(20(27)11-6-14-4-2-3-5-14)19-10-7-15(13-24-19)21(23)25-28/h7-10,12-14,28H,2-6,11H2,1H3,(H2,23,25)