3-[2-(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)ethanoyl-(phenylmethyl)amino]propanamide

Systemtic Name: 3-[2-(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)ethanoyl-(phenylmethyl)amino]propanamide Openeye Name: 3-[benzyl-[2-(5-cyano-3,4-dimethyl-6-oxo-pyridazin-1-yl)acetyl]amino]propanamide CAS Name: 3-[[2-(5-cyano-3,4-dimethyl-6-oxo-1-pyridazinyl)-1-oxoethyl]-(phenylmethyl)amino]propanamide IUPAC Name: 3-[benzyl-[2-(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)acetyl]amino]propanamide Traditional Name: 3-[benzyl-[2-(5-cyano-6-keto-3,4-dimethyl-pyridazin-1-yl)acetyl]amino]propionamide Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC(=O)N(CCC(=O)N)CC2=CC=CC=C2)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC(=O)N(CCC(=O)N)CC2=CC=CC=C2)C#N

InChI

InChI=1S/C19H21N5O3/c1-13-14(2)22-24(19(27)16(13)10-20)12-18(26)23(9-8-17(21)25)11-15-6-4-3-5-7-15/h3-7H,8-9,11-12H2,1-2H3,(H2,21,25)