4-methyl-2-(4-methylpiperidin-1-yl)-5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidine

Systemtic Name: 4-methyl-2-(4-methylpiperidin-1-yl)-5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidine Openeye Name: 4-methyl-2-(4-methyl-1-piperidyl)-5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidine CAS Name: 4-methyl-2-(4-methyl-1-piperidinyl)-5-nitro-6-(4-phenyl-1-piperazinyl)pyrimidine IUPAC Name: 4-methyl-2-(4-methylpiperidin-1-yl)-5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidine Traditional Name: 4-methyl-2-(4-methylpiperidino)-5-nitro-6-(4-phenylpiperazino)pyrimidine Formula: C21H28N6O2 MolecularWeight: 396.48602

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC(=C(C(=N2)N3CCN(CC3)C4=CC=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1CCN(CC1)C2=NC(=C(C(=N2)N3CCN(CC3)C4=CC=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C21H28N6O2/c1-16-8-10-26(11-9-16)21-22-17(2)19(27(28)29)20(23-21)25-14-12-24(13-15-25)18-6-4-3-5-7-18/h3-7,16H,8-15H2,1-2H3