methyl 2-[[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]-methyl-amino]ethanoate

Systemtic Name: methyl 2-[[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]-methyl-amino]ethanoate Openeye Name: methyl 2-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]-N-methyl-anilino]acetate CAS Name: 2-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]-N-methylanilino]acetic acid methyl ester IUPAC Name: methyl 2-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]-N-methylanilino]acetate Traditional Name: 2-[4-[5-(4-amidinophenyl)-1H-imidazol-2-yl]-N-methyl-anilino]acetic acid methyl ester Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)C1=CC=C(C=C1)C2=NC=C(N2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CN(CC(=O)OC)C1=CC=C(C=C1)C2=NC=C(N2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H21N5O2/c1-25(12-18(26)27-2)16-9-7-15(8-10-16)20-23-11-17(24-20)13-3-5-14(6-4-13)19(21)22/h3-11H,12H2,1-2H3,(H3,21,22)(H,23,24)