5-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine

Systemtic Name: 5-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine Openeye Name: 5-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine CAS Name: 5-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]-4-methyl-6-(3-nitrophenyl)-2-phenylpyrimidine IUPAC Name: 5-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-4-methyl-6-(3-nitrophenyl)-2-phenylpyrimidine Traditional Name: 5-[[4-(2-methoxyphenyl)piperazino]methyl]-4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine Formula: C29H29N5O3 MolecularWeight: 495.57226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1CN2CCN(CC2)C3=CC=CC=C3OC)C4=CC(=CC=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CC1=NC(=NC(=C1CN2CCN(CC2)C3=CC=CC=C3OC)C4=CC(=CC=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C29H29N5O3/c1-21-25(20-32-15-17-33(18-16-32)26-13-6-7-14-27(26)37-2)28(23-11-8-12-24(19-23)34(35)36)31-29(30-21)22-9-4-3-5-10-22/h3-14,19H,15-18,20H2,1-2H3