N-[(1S)-1-[4-(4-carbamimidoylphenyl)-1-methyl-imidazol-2-yl]-2-phenyl-ethyl]benzamide

Systemtic Name: N-[(1S)-1-[4-(4-carbamimidoylphenyl)-1-methyl-imidazol-2-yl]-2-phenyl-ethyl]benzamide Openeye Name: N-[(1S)-1-[4-(4-carbamimidoylphenyl)-1-methyl-imidazol-2-yl]-2-phenyl-ethyl]benzamide CAS Name: N-[(1S)-1-[4-(4-carbamimidoylphenyl)-1-methyl-2-imidazolyl]-2-phenylethyl]benzamide IUPAC Name: N-[(1S)-1-[4-(4-carbamimidoylphenyl)-1-methylimidazol-2-yl]-2-phenylethyl]benzamide Traditional Name: N-[(1S)-1-[4-(4-amidinophenyl)-1-methyl-imidazol-2-yl]-2-phenyl-ethyl]benzamide Formula: C26H25N5O MolecularWeight: 423.5096

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C(=N)N

Isomeric SMILES

CN1C=C(N=C1[C@H](CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C26H25N5O/c1-31-17-23(19-12-14-20(15-13-19)24(27)28)29-25(31)22(16-18-8-4-2-5-9-18)30-26(32)21-10-6-3-7-11-21/h2-15,17,22H,16H2,1H3,(H3,27,28)(H,30,32)/t22-/m0/s1