2-(4-chlorophenyl)-N-(2-dimethylaminoethyl)-4-methyl-6-(3-nitrophenyl)pyrimidine-5-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-N-(2-dimethylaminoethyl)-4-methyl-6-(3-nitrophenyl)pyrimidine-5-carboxamide Openeye Name: 2-(4-chlorophenyl)-N-(2-dimethylaminoethyl)-4-methyl-6-(3-nitrophenyl)pyrimidine-5-carboxamide CAS Name: 2-(4-chlorophenyl)-N-(2-dimethylaminoethyl)-4-methyl-6-(3-nitrophenyl)-5-pyrimidinecarboxamide IUPAC Name: 2-(4-chlorophenyl)-N-(2-dimethylaminoethyl)-4-methyl-6-(3-nitrophenyl)pyrimidine-5-carboxamide Traditional Name: 2-(4-chlorophenyl)-N-(2-dimethylaminoethyl)-4-methyl-6-(3-nitrophenyl)pyrimidine-5-carboxamide Formula: C22H22ClN5O3 MolecularWeight: 439.89478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1C(=O)NCCN(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NC(=NC(=C1C(=O)NCCN(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H22ClN5O3/c1-14-19(22(29)24-11-12-27(2)3)20(16-5-4-6-18(13-16)28(30)31)26-21(25-14)15-7-9-17(23)10-8-15/h4-10,13H,11-12H2,1-3H3,(H,24,29)