N-[(4-carbamimidoylphenyl)methyl]-2-[(2R)-3-oxidanylidene-4-(2-phenylethanoylamino)morpholin-2-yl]ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[(2R)-3-oxidanylidene-4-(2-phenylethanoylamino)morpholin-2-yl]ethanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-[(2R)-3-oxo-4-[(2-phenylacetyl)amino]morpholin-2-yl]acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[(2R)-3-oxo-4-[(1-oxo-2-phenylethyl)amino]-2-morpholinyl]acetamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-[(2R)-3-oxo-4-[(2-phenylacetyl)amino]morpholin-2-yl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[(2R)-3-keto-4-[(2-phenylacetyl)amino]morpholin-2-yl]acetamide Formula: C22H25N5O4 MolecularWeight: 423.465

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C(=O)N1NC(=O)CC2=CC=CC=C2)CC(=O)NCC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1CO[C@@H](C(=O)N1NC(=O)CC2=CC=CC=C2)CC(=O)NCC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H25N5O4/c23-21(24)17-8-6-16(7-9-17)14-25-19(28)13-18-22(30)27(10-11-31-18)26-20(29)12-15-4-2-1-3-5-15/h1-9,18H,10-14H2,(H3,23,24)(H,25,28)(H,26,29)/t18-/m1/s1