ethyl 2-[[2-[(4-carbamimidoylphenyl)methyl]-1-(2-ethoxy-2-oxidanylidene-ethyl)benzimidazol-5-yl]amino]ethanoate

Systemtic Name: ethyl 2-[[2-[(4-carbamimidoylphenyl)methyl]-1-(2-ethoxy-2-oxidanylidene-ethyl)benzimidazol-5-yl]amino]ethanoate Openeye Name: ethyl 2-[[2-[(4-carbamimidoylphenyl)methyl]-1-(2-ethoxy-2-oxo-ethyl)benzimidazol-5-yl]amino]acetate CAS Name: 2-[[2-[(4-carbamimidoylphenyl)methyl]-1-(2-ethoxy-2-oxoethyl)-5-benzimidazolyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(4-carbamimidoylphenyl)methyl]-1-(2-ethoxy-2-oxoethyl)benzimidazol-5-yl]amino]acetate Traditional Name: 2-[[2-(4-amidinobenzyl)-1-(2-ethoxy-2-keto-ethyl)benzimidazol-5-yl]amino]acetic acid ethyl ester Formula: C23H27N5O4 MolecularWeight: 437.49158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC1=CC2=C(C=C1)N(C(=N2)CC3=CC=C(C=C3)C(=N)N)CC(=O)OCC

Isomeric SMILES

CCOC(=O)CNC1=CC2=C(C=C1)N(C(=N2)CC3=CC=C(C=C3)C(=N)N)CC(=O)OCC

InChI

InChI=1S/C23H27N5O4/c1-3-31-21(29)13-26-17-9-10-19-18(12-17)27-20(28(19)14-22(30)32-4-2)11-15-5-7-16(8-6-15)23(24)25/h5-10,12,26H,3-4,11,13-14H2,1-2H3,(H3,24,25)