N-[[4-carbamimidoyl-2-[2-(methylamino)-2-oxidanylidene-ethoxy]phenyl]methyl]-5-chloranyl-pyridine-3-carboxamide

Systemtic Name: N-[[4-carbamimidoyl-2-[2-(methylamino)-2-oxidanylidene-ethoxy]phenyl]methyl]-5-chloranyl-pyridine-3-carboxamide Openeye Name: N-[[4-carbamimidoyl-2-[2-(methylamino)-2-oxo-ethoxy]phenyl]methyl]-5-chloro-pyridine-3-carboxamide CAS Name: N-[[4-carbamimidoyl-2-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-5-chloro-3-pyridinecarboxamide IUPAC Name: N-[[4-carbamimidoyl-2-[2-(methylamino)-2-oxoethoxy]phenyl]methyl]-5-chloropyridine-3-carboxamide Traditional Name: N-[4-amidino-2-[2-keto-2-(methylamino)ethoxy]benzyl]-5-chloro-nicotinamide Formula: C17H18ClN5O3 MolecularWeight: 375.80952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)COC1=C(C=CC(=C1)C(=N)N)CNC(=O)C2=CC(=CN=C2)Cl

Isomeric SMILES

CNC(=O)COC1=C(C=CC(=C1)C(=N)N)CNC(=O)C2=CC(=CN=C2)Cl

InChI

InChI=1S/C17H18ClN5O3/c1-21-15(24)9-26-14-5-10(16(19)20)2-3-11(14)7-23-17(25)12-4-13(18)8-22-6-12/h2-6,8H,7,9H2,1H3,(H3,19,20)(H,21,24)(H,23,25)