5-ethyl-4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine; (1-ethylpyrrolidin-2-yl)methanamine

Systemtic Name: 5-ethyl-4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine; (1-ethylpyrrolidin-2-yl)methanamine Openeye Name: 5-ethyl-4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine; (1-ethylpyrrolidin-2-yl)methanamine CAS Name: 5-ethyl-4-methyl-6-(3-nitrophenyl)-2-phenylpyrimidine; (1-ethyl-2-pyrrolidinyl)methanamine IUPAC Name: 5-ethyl-4-methyl-6-(3-nitrophenyl)-2-phenylpyrimidine; (1-ethylpyrrolidin-2-yl)methanamine Traditional Name: 5-ethyl-4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine; (1-ethylpyrrolidin-2-yl)methylamine Formula: C26H33N5O2 MolecularWeight: 447.57252

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1C)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-].CCN1CCCC1CN

Isomeric SMILES

CCC1=C(N=C(N=C1C)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-].CCN1CCCC1CN

InChI

InChI=1S/C19H17N3O2.C7H16N2/c1-3-17-13(2)20-19(14-8-5-4-6-9-14)21-18(17)15-10-7-11-16(12-15)22(23)24;1-2-9-5-3-4-7(9)6-8/h4-12H,3H2,1-2H3;7H,2-6,8H2,1H3