N-[[4-azanyl-3,5-bis(chloranyl)phenyl]methyl]-N-(3-cyanophenyl)-3-oxidanylidene-3-pyrimidin-2-yl-propanamide

Systemtic Name: N-[[4-azanyl-3,5-bis(chloranyl)phenyl]methyl]-N-(3-cyanophenyl)-3-oxidanylidene-3-pyrimidin-2-yl-propanamide Openeye Name: N-[(4-amino-3,5-dichloro-phenyl)methyl]-N-(3-cyanophenyl)-3-oxo-3-pyrimidin-2-yl-propanamide CAS Name: N-[(4-amino-3,5-dichlorophenyl)methyl]-N-(3-cyanophenyl)-3-oxo-3-(2-pyrimidinyl)propanamide IUPAC Name: N-[(4-amino-3,5-dichlorophenyl)methyl]-N-(3-cyanophenyl)-3-oxo-3-pyrimidin-2-ylpropanamide Traditional Name: N-(4-amino-3,5-dichloro-benzyl)-N-(3-cyanophenyl)-3-keto-3-(2-pyrimidyl)propionamide Formula: C21H15Cl2N5O2 MolecularWeight: 440.2821

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N(CC2=CC(=C(C(=C2)Cl)N)Cl)C(=O)CC(=O)C3=NC=CC=N3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)N(CC2=CC(=C(C(=C2)Cl)N)Cl)C(=O)CC(=O)C3=NC=CC=N3)C#N

InChI

InChI=1S/C21H15Cl2N5O2/c22-16-8-14(9-17(23)20(16)25)12-28(15-4-1-3-13(7-15)11-24)19(30)10-18(29)21-26-5-2-6-27-21/h1-9H,10,12,25H2