4-(3-methylpiperidin-1-yl)-5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidine

Systemtic Name: 4-(3-methylpiperidin-1-yl)-5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidine Openeye Name: 4-(3-methyl-1-piperidyl)-5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidine CAS Name: 4-(3-methyl-1-piperidinyl)-5-nitro-6-(4-phenyl-1-piperazinyl)pyrimidine IUPAC Name: 4-(3-methylpiperidin-1-yl)-5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidine Traditional Name: 4-(3-methylpiperidino)-5-nitro-6-(4-phenylpiperazino)pyrimidine Formula: C20H26N6O2 MolecularWeight: 382.45944

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C(=NC=N2)N3CCN(CC3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C(=NC=N2)N3CCN(CC3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H26N6O2/c1-16-6-5-9-25(14-16)20-18(26(27)28)19(21-15-22-20)24-12-10-23(11-13-24)17-7-3-2-4-8-17/h2-4,7-8,15-16H,5-6,9-14H2,1H3