3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]propanamide

Systemtic Name: 3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]propanamide Openeye Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-[[4-(isopropylcarbamoylamino)phenyl]methyl]propanamide CAS Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-[[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]propanamide IUPAC Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]propanamide Traditional Name: 3-(5-cyano-6-keto-2,4-dimethyl-1H-pyridin-3-yl)-N-[4-(isopropylcarbamoylamino)benzyl]propionamide Formula: C22H27N5O3 MolecularWeight: 409.48148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1CCC(=O)NCC2=CC=C(C=C2)NC(=O)NC(C)C)C)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=C1CCC(=O)NCC2=CC=C(C=C2)NC(=O)NC(C)C)C)C#N

InChI

InChI=1S/C22H27N5O3/c1-13(2)25-22(30)27-17-7-5-16(6-8-17)12-24-20(28)10-9-18-14(3)19(11-23)21(29)26-15(18)4/h5-8,13H,9-10,12H2,1-4H3,(H,24,28)(H,26,29)(H2,25,27,30)