N-(4-cyanophenyl)-N-[(3,4-dichlorophenyl)methyl]-3-oxidanylidene-3-pyrimidin-2-yl-propanamide

Systemtic Name: N-(4-cyanophenyl)-N-[(3,4-dichlorophenyl)methyl]-3-oxidanylidene-3-pyrimidin-2-yl-propanamide Openeye Name: N-(4-cyanophenyl)-N-[(3,4-dichlorophenyl)methyl]-3-oxo-3-pyrimidin-2-yl-propanamide CAS Name: N-(4-cyanophenyl)-N-[(3,4-dichlorophenyl)methyl]-3-oxo-3-(2-pyrimidinyl)propanamide IUPAC Name: N-(4-cyanophenyl)-N-[(3,4-dichlorophenyl)methyl]-3-oxo-3-pyrimidin-2-ylpropanamide Traditional Name: N-(4-cyanophenyl)-N-(3,4-dichlorobenzyl)-3-keto-3-(2-pyrimidyl)propionamide Formula: C21H14Cl2N4O2 MolecularWeight: 425.26746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14Cl2N4O2/c22-17-7-4-15(10-18(17)23)13-27(16-5-2-14(12-24)3-6-16)20(29)11-19(28)21-25-8-1-9-26-21/h1-10H,11,13H2