4-(aminomethyl)-N-[1-[4-(1-azanyl-4-oxidanylidene-3H-phthalazin-6-yl)-5-methyl-1H-imidazol-2-yl]-2-phenyl-ethyl]cyclohexane-1-carboxamide

Systemtic Name: 4-(aminomethyl)-N-[1-[4-(1-azanyl-4-oxidanylidene-3H-phthalazin-6-yl)-5-methyl-1H-imidazol-2-yl]-2-phenyl-ethyl]cyclohexane-1-carboxamide Openeye Name: 4-(aminomethyl)-N-[1-[4-(1-amino-4-oxo-3H-phthalazin-6-yl)-5-methyl-1H-imidazol-2-yl]-2-phenyl-ethyl]cyclohexanecarboxamide CAS Name: 4-(aminomethyl)-N-[1-[4-(1-amino-4-oxo-3H-phthalazin-6-yl)-5-methyl-1H-imidazol-2-yl]-2-phenylethyl]-1-cyclohexanecarboxamide IUPAC Name: 4-(aminomethyl)-N-[1-[4-(1-amino-4-oxo-3H-phthalazin-6-yl)-5-methyl-1H-imidazol-2-yl]-2-phenylethyl]cyclohexane-1-carboxamide Traditional Name: N-[1-[4-(1-amino-4-keto-3H-phthalazin-6-yl)-5-methyl-1H-imidazol-2-yl]-2-phenyl-ethyl]-4-(aminomethyl)cyclohexanecarboxamide Formula: C28H33N7O2 MolecularWeight: 499.60732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)C(CC2=CC=CC=C2)NC(=O)C3CCC(CC3)CN)C4=CC5=C(C=C4)C(=NNC5=O)N

Isomeric SMILES

CC1=C(N=C(N1)C(CC2=CC=CC=C2)NC(=O)C3CCC(CC3)CN)C4=CC5=C(C=C4)C(=NNC5=O)N

InChI

InChI=1S/C28H33N7O2/c1-16-24(20-11-12-21-22(14-20)28(37)35-34-25(21)30)33-26(31-16)23(13-17-5-3-2-4-6-17)32-27(36)19-9-7-18(15-29)8-10-19/h2-6,11-12,14,18-19,23H,7-10,13,15,29H2,1H3,(H2,30,34)(H,31,33)(H,32,36)(H,35,37)