methyl 3-[[2-(4-carbamimidoylphenyl)-6-[(2-methoxy-2-oxidanylidene-ethyl)-methyl-amino]-1-methyl-benzimidazol-5-yl]carbonylamino]propanoate

Systemtic Name: methyl 3-[[2-(4-carbamimidoylphenyl)-6-[(2-methoxy-2-oxidanylidene-ethyl)-methyl-amino]-1-methyl-benzimidazol-5-yl]carbonylamino]propanoate Openeye Name: methyl 3-[[2-(4-carbamimidoylphenyl)-6-[(2-methoxy-2-oxo-ethyl)-methyl-amino]-1-methyl-benzimidazole-5-carbonyl]amino]propanoate CAS Name: 3-[[[2-(4-carbamimidoylphenyl)-6-[(2-methoxy-2-oxoethyl)-methylamino]-1-methyl-5-benzimidazolyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-carbamimidoylphenyl)-6-[(2-methoxy-2-oxoethyl)-methylamino]-1-methylbenzimidazole-5-carbonyl]amino]propanoate Traditional Name: 3-[[2-(4-amidinophenyl)-6-[(2-keto-2-methoxy-ethyl)-methyl-amino]-1-methyl-benzimidazole-5-carbonyl]amino]propionic acid methyl ester Formula: C24H28N6O5 MolecularWeight: 480.51632

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C(=C2)N(C)CC(=O)OC)C(=O)NCCC(=O)OC)N=C1C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C(=C2)N(C)CC(=O)OC)C(=O)NCCC(=O)OC)N=C1C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C24H28N6O5/c1-29(13-21(32)35-4)18-12-19-17(11-16(18)24(33)27-10-9-20(31)34-3)28-23(30(19)2)15-7-5-14(6-8-15)22(25)26/h5-8,11-12H,9-10,13H2,1-4H3,(H3,25,26)(H,27,33)