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

Systemtic Name: methyl 2-[[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]-ethanoyl-amino]ethanoate Openeye Name: methyl 2-[N-acetyl-4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]anilino]acetate CAS Name: 2-[N-acetyl-4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]anilino]acetic acid methyl ester IUPAC Name: methyl 2-[N-acetyl-4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]anilino]acetate Traditional Name: 2-[N-acetyl-4-[5-(4-amidinophenyl)-1H-imidazol-2-yl]anilino]acetic acid methyl ester Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N5O3/c1-13(27)26(12-19(28)29-2)17-9-7-16(8-10-17)21-24-11-18(25-21)14-3-5-15(6-4-14)20(22)23/h3-11H,12H2,1-2H3,(H3,22,23)(H,24,25)