N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-2-(3-methylphenyl)-3-oxidanylidene-1,4-dihydropyridazine-6-carboxamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-2-(3-methylphenyl)-3-oxidanylidene-1,4-dihydropyridazine-6-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-2-(m-tolyl)-3-oxo-1,4-dihydropyridazine-6-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-(3-methylphenyl)-3-oxo-1,4-dihydropyridazine-6-carboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-(3-methylphenyl)-3-oxo-1,4-dihydropyridazine-6-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-3-keto-2-(m-tolyl)-1,4-dihydropyridazine-6-carboxamide Formula: C27H25N5O2 MolecularWeight: 451.5197

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)CC=C(N2)C(=O)NC(CC3=CC=CC=C3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)CC=C(N2)C(=O)N[C@@H](CC3=CC=CC=C3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C27H25N5O2/c1-18-8-7-11-20(16-18)32-25(33)15-14-23(31-32)27(34)30-24(17-19-9-3-2-4-10-19)26-28-21-12-5-6-13-22(21)29-26/h2-14,16,24,31H,15,17H2,1H3,(H,28,29)(H,30,34)/t24-/m0/s1