N-(2-dimethylaminoethyl)-4-ethyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-ethyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-4-ethyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide CAS Name: N-(2-dimethylaminoethyl)-4-ethyl-6-(3-nitrophenyl)-2-phenyl-5-pyrimidinecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-4-ethyl-6-(3-nitrophenyl)-2-phenylpyrimidine-5-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-4-ethyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide Formula: C23H25N5O3 MolecularWeight: 419.4763

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NC(=C1C(=O)NCCN(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCC1=NC(=NC(=C1C(=O)NCCN(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C23H25N5O3/c1-4-19-20(23(29)24-13-14-27(2)3)21(17-11-8-12-18(15-17)28(30)31)26-22(25-19)16-9-6-5-7-10-16/h5-12,15H,4,13-14H2,1-3H3,(H,24,29)