N-[(4-carbamimidoylphenyl)methyl]-1-(2-cyclohexyl-2-oxidanyl-ethanoyl)azetidine-2-carboxamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-1-(2-cyclohexyl-2-oxidanyl-ethanoyl)azetidine-2-carboxamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-1-(2-cyclohexyl-2-hydroxy-acetyl)azetidine-2-carboxamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-1-(2-cyclohexyl-2-hydroxy-1-oxoethyl)-2-azetidinecarboxamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-1-(2-cyclohexyl-2-hydroxyacetyl)azetidine-2-carboxamide Traditional Name: N-(4-amidinobenzyl)-1-(2-cyclohexyl-2-hydroxy-acetyl)azetidine-2-carboxamide Formula: C20H28N4O3 MolecularWeight: 372.46132

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(=O)N2CCC2C(=O)NCC3=CC=C(C=C3)C(=N)N)O

Isomeric SMILES

C1CCC(CC1)C(C(=O)N2CCC2C(=O)NCC3=CC=C(C=C3)C(=N)N)O

InChI

InChI=1S/C20H28N4O3/c21-18(22)15-8-6-13(7-9-15)12-23-19(26)16-10-11-24(16)20(27)17(25)14-4-2-1-3-5-14/h6-9,14,16-17,25H,1-5,10-12H2,(H3,21,22)(H,23,26)