4-(2-azanylethanoyl)-N-[(4-carbamimidoylphenyl)methyl]-N-methyl-1-phenyl-4-azabicyclo[3.1.0]hexane-5-carboxamide

Systemtic Name: 4-(2-azanylethanoyl)-N-[(4-carbamimidoylphenyl)methyl]-N-methyl-1-phenyl-4-azabicyclo[3.1.0]hexane-5-carboxamide Openeye Name: 4-(2-aminoacetyl)-N-[(4-carbamimidoylphenyl)methyl]-N-methyl-1-phenyl-4-azabicyclo[3.1.0]hexane-5-carboxamide CAS Name: 4-(2-amino-1-oxoethyl)-N-[(4-carbamimidoylphenyl)methyl]-N-methyl-1-phenyl-4-azabicyclo[3.1.0]hexane-5-carboxamide IUPAC Name: 4-(2-aminoacetyl)-N-[(4-carbamimidoylphenyl)methyl]-N-methyl-1-phenyl-4-azabicyclo[3.1.0]hexane-5-carboxamide Traditional Name: N-(4-amidinobenzyl)-4-glycyl-N-methyl-1-phenyl-4-azabicyclo[3.1.0]hexane-5-carboxamide Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=N)N)C(=O)C23CC2(CCN3C(=O)CN)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=N)N)C(=O)C23CC2(CCN3C(=O)CN)C4=CC=CC=C4

InChI

InChI=1S/C23H27N5O2/c1-27(14-16-7-9-17(10-8-16)20(25)26)21(30)23-15-22(23,18-5-3-2-4-6-18)11-12-28(23)19(29)13-24/h2-10H,11-15,24H2,1H3,(H3,25,26)