(2S)-2-[3-(3-acetamido-4-methyl-phenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(3-chloranyl-4-methoxy-phenyl)propanamide

Systemtic Name: (2S)-2-[3-(3-acetamido-4-methyl-phenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(3-chloranyl-4-methoxy-phenyl)propanamide Openeye Name: (2S)-2-[3-(3-acetamido-4-methyl-phenyl)-6-oxo-pyridazin-1-yl]-N-(3-chloro-4-methoxy-phenyl)propanamide CAS Name: (2S)-2-[3-(3-acetamido-4-methylphenyl)-6-oxo-1-pyridazinyl]-N-(3-chloro-4-methoxyphenyl)propanamide IUPAC Name: (2S)-2-[3-(3-acetamido-4-methylphenyl)-6-oxopyridazin-1-yl]-N-(3-chloro-4-methoxyphenyl)propanamide Traditional Name: (2S)-2-[3-(3-acetamido-4-methyl-phenyl)-6-keto-pyridazin-1-yl]-N-(3-chloro-4-methoxy-phenyl)propionamide Formula: C23H23ClN4O4 MolecularWeight: 454.90612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)C(C)C(=O)NC3=CC(=C(C=C3)OC)Cl)NC(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)[C@@H](C)C(=O)NC3=CC(=C(C=C3)OC)Cl)NC(=O)C

InChI

InChI=1S/C23H23ClN4O4/c1-13-5-6-16(11-20(13)25-15(3)29)19-8-10-22(30)28(27-19)14(2)23(31)26-17-7-9-21(32-4)18(24)12-17/h5-12,14H,1-4H3,(H,25,29)(H,26,31)/t14-/m0/s1