N-(2-dimethylaminoethyl)-4-(4-nitrophenyl)-2-pyridin-4-yl-pyrimidine-5-carboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-(4-nitrophenyl)-2-pyridin-4-yl-pyrimidine-5-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-4-(4-nitrophenyl)-2-(4-pyridyl)pyrimidine-5-carboxamide CAS Name: N-(2-dimethylaminoethyl)-4-(4-nitrophenyl)-2-pyridin-4-yl-5-pyrimidinecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-4-(4-nitrophenyl)-2-pyridin-4-ylpyrimidine-5-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-4-(4-nitrophenyl)-2-(4-pyridyl)pyrimidine-5-carboxamide Formula: C20H20N6O3 MolecularWeight: 392.4112

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CN=C(N=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=NC=C3

Isomeric SMILES

CN(C)CCNC(=O)C1=CN=C(N=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=NC=C3

InChI

InChI=1S/C20H20N6O3/c1-25(2)12-11-22-20(27)17-13-23-19(15-7-9-21-10-8-15)24-18(17)14-3-5-16(6-4-14)26(28)29/h3-10,13H,11-12H2,1-2H3,(H,22,27)