4-(3-chlorophenyl)-6-methyl-N-[(E)-3-phenylprop-2-enyl]-2-pyridin-3-yl-pyrimidine-5-carboxamide

Systemtic Name: 4-(3-chlorophenyl)-6-methyl-N-[(E)-3-phenylprop-2-enyl]-2-pyridin-3-yl-pyrimidine-5-carboxamide Openeye Name: 4-(3-chlorophenyl)-N-[(E)-cinnamyl]-6-methyl-2-(3-pyridyl)pyrimidine-5-carboxamide CAS Name: 4-(3-chlorophenyl)-6-methyl-N-[(E)-3-phenylprop-2-enyl]-2-(3-pyridinyl)-5-pyrimidinecarboxamide IUPAC Name: 4-(3-chlorophenyl)-6-methyl-N-[(E)-3-phenylprop-2-enyl]-2-pyridin-3-ylpyrimidine-5-carboxamide Traditional Name: 4-(3-chlorophenyl)-N-[(E)-cinnamyl]-6-methyl-2-(3-pyridyl)pyrimidine-5-carboxamide Formula: C26H21ClN4O MolecularWeight: 440.92414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1C(=O)NCC=CC2=CC=CC=C2)C3=CC(=CC=C3)Cl)C4=CN=CC=C4

Isomeric SMILES

CC1=NC(=NC(=C1C(=O)NC/C=C/C2=CC=CC=C2)C3=CC(=CC=C3)Cl)C4=CN=CC=C4

InChI

InChI=1S/C26H21ClN4O/c1-18-23(26(32)29-15-6-10-19-8-3-2-4-9-19)24(20-11-5-13-22(27)16-20)31-25(30-18)21-12-7-14-28-17-21/h2-14,16-17H,15H2,1H3,(H,29,32)/b10-6+