(2R)-2-[3-(2,5-dimethylphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-phenyl-butanamide

Systemtic Name: (2R)-2-[3-(2,5-dimethylphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-phenyl-butanamide Openeye Name: (2R)-2-[3-(2,5-dimethylphenyl)-6-oxo-pyridazin-1-yl]-N-phenyl-butanamide CAS Name: (2R)-2-[3-(2,5-dimethylphenyl)-6-oxo-1-pyridazinyl]-N-phenylbutanamide IUPAC Name: (2R)-2-[3-(2,5-dimethylphenyl)-6-oxopyridazin-1-yl]-N-phenylbutanamide Traditional Name: (2R)-2-[3-(2,5-dimethylphenyl)-6-keto-pyridazin-1-yl]-N-phenyl-butyramide Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)N2C(=O)C=CC(=N2)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CC[C@H](C(=O)NC1=CC=CC=C1)N2C(=O)C=CC(=N2)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C22H23N3O2/c1-4-20(22(27)23-17-8-6-5-7-9-17)25-21(26)13-12-19(24-25)18-14-15(2)10-11-16(18)3/h5-14,20H,4H2,1-3H3,(H,23,27)/t20-/m1/s1