2,4-dimethyl-6-(3-nitrophenyl)-N-(3-phenylpropyl)pyrimidine-5-carboxamide

Systemtic Name: 2,4-dimethyl-6-(3-nitrophenyl)-N-(3-phenylpropyl)pyrimidine-5-carboxamide Openeye Name: 2,4-dimethyl-6-(3-nitrophenyl)-N-(3-phenylpropyl)pyrimidine-5-carboxamide CAS Name: 2,4-dimethyl-6-(3-nitrophenyl)-N-(3-phenylpropyl)-5-pyrimidinecarboxamide IUPAC Name: 2,4-dimethyl-6-(3-nitrophenyl)-N-(3-phenylpropyl)pyrimidine-5-carboxamide Traditional Name: 2,4-dimethyl-6-(3-nitrophenyl)-N-(3-phenylpropyl)pyrimidine-5-carboxamide Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1C(=O)NCCCC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=NC(=NC(=C1C(=O)NCCCC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C22H22N4O3/c1-15-20(22(27)23-13-7-10-17-8-4-3-5-9-17)21(25-16(2)24-15)18-11-6-12-19(14-18)26(28)29/h3-6,8-9,11-12,14H,7,10,13H2,1-2H3,(H,23,27)