N-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]-4-methoxy-benzamide; sulfuric acid

Systemtic Name: N-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]-4-methoxy-benzamide; sulfuric acid Openeye Name: N-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]-4-methoxy-benzamide; sulfuric acid CAS Name: N-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]-4-methoxybenzamide; sulfuric acid IUPAC Name: N-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]-4-methoxybenzamide; sulfuric acid Traditional Name: N-[4-(2-imidazolin-2-ylamino)benzyl]-4-methoxy-benzamide; sulfuric acid Formula: C36H42N8O8S MolecularWeight: 746.83248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)NC3=NCCN3.COC1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)NC3=NCCN3.OS(=O)(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)NC3=NCCN3.COC1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)NC3=NCCN3.OS(=O)(=O)O

InChI

InChI=1S/2C18H20N4O2.H2O4S/c2*1-24-16-8-4-14(5-9-16)17(23)21-12-13-2-6-15(7-3-13)22-18-19-10-11-20-18;1-5(2,3)4/h2*2-9H,10-12H2,1H3,(H,21,23)(H2,19,20,22);(H2,1,2,3,4)