4-methyl-N-[2-[methyl-(phenylmethyl)amino]ethyl]-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide

Systemtic Name: 4-methyl-N-[2-[methyl-(phenylmethyl)amino]ethyl]-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide Openeye Name: N-[2-[benzyl(methyl)amino]ethyl]-4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide CAS Name: 4-methyl-N-[2-[methyl-(phenylmethyl)amino]ethyl]-6-(3-nitrophenyl)-2-phenyl-5-pyrimidinecarboxamide IUPAC Name: N-[2-[benzyl(methyl)amino]ethyl]-4-methyl-6-(3-nitrophenyl)-2-phenylpyrimidine-5-carboxamide Traditional Name: N-[2-[benzyl(methyl)amino]ethyl]-4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide Formula: C28H27N5O3 MolecularWeight: 481.54568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1C(=O)NCCN(C)CC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=NC(=C1C(=O)NCCN(C)CC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C28H27N5O3/c1-20-25(28(34)29-16-17-32(2)19-21-10-5-3-6-11-21)26(23-14-9-15-24(18-23)33(35)36)31-27(30-20)22-12-7-4-8-13-22/h3-15,18H,16-17,19H2,1-2H3,(H,29,34)