N1,N3-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-5-methoxy-benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-5-methoxy-benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-5-methoxy-benzene-1,3-dicarboxamide CAS Name: N1,N3-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-5-methoxybenzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-5-methoxybenzene-1,3-dicarboxamide Traditional Name: N,N'-bis[4-(2-imidazolin-2-ylamino)phenyl]-5-methoxy-isophthalamide Formula: C27H28N8O3 MolecularWeight: 512.56302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)NC3=NCCN3)C(=O)NC4=CC=C(C=C4)NC5=NCCN5

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)NC3=NCCN3)C(=O)NC4=CC=C(C=C4)NC5=NCCN5

InChI

InChI=1S/C27H28N8O3/c1-38-23-15-17(24(36)32-19-2-6-21(7-3-19)34-26-28-10-11-29-26)14-18(16-23)25(37)33-20-4-8-22(9-5-20)35-27-30-12-13-31-27/h2-9,14-16H,10-13H2,1H3,(H,32,36)(H,33,37)(H2,28,29,34)(H2,30,31,35)