5-chloranyl-N-[(3,4-dimethoxyphenyl)methyl]-2-(phenethylamino)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[(3,4-dimethoxyphenyl)methyl]-2-(phenethylamino)pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[(3,4-dimethoxyphenyl)methyl]-2-(phenethylamino)pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[(3,4-dimethoxyphenyl)methyl]-2-(phenethylamino)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[(3,4-dimethoxyphenyl)methyl]-2-(phenethylamino)pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(phenethylamino)-N-veratryl-pyrimidine-4-carboxamide Formula: C22H23ClN4O3 MolecularWeight: 426.89602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=NC(=NC=C2Cl)NCCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=NC(=NC=C2Cl)NCCC3=CC=CC=C3)OC

InChI

InChI=1S/C22H23ClN4O3/c1-29-18-9-8-16(12-19(18)30-2)13-25-21(28)20-17(23)14-26-22(27-20)24-11-10-15-6-4-3-5-7-15/h3-9,12,14H,10-11,13H2,1-2H3,(H,25,28)(H,24,26,27)