N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-6-keto-1-(2-phenoxyethyl)pyridazine-3-carboxamide Formula: C22H21N5O3 MolecularWeight: 403.43384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1)NC(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

Isomeric SMILES

C[C@@H](C1=NC2=CC=CC=C2N1)NC(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

InChI

InChI=1S/C22H21N5O3/c1-15(21-24-17-9-5-6-10-18(17)25-21)23-22(29)19-11-12-20(28)27(26-19)13-14-30-16-7-3-2-4-8-16/h2-12,15H,13-14H2,1H3,(H,23,29)(H,24,25)/t15-/m0/s1