N-ethyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(3-methylphenyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-ethyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(3-methylphenyl)-5-nitro-pyrimidin-4-amine Openeye Name: N-ethyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(m-tolyl)-5-nitro-pyrimidin-4-amine CAS Name: N-ethyl-6-[4-(4-methoxyphenyl)-1-piperazinyl]-N-(3-methylphenyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-ethyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(3-methylphenyl)-5-nitropyrimidin-4-amine Traditional Name: ethyl-[6-[4-(4-methoxyphenyl)piperazino]-5-nitro-pyrimidin-4-yl]-(m-tolyl)amine Formula: C24H28N6O3 MolecularWeight: 448.51752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28N6O3/c1-4-29(20-7-5-6-18(2)16-20)24-22(30(31)32)23(25-17-26-24)28-14-12-27(13-15-28)19-8-10-21(33-3)11-9-19/h5-11,16-17H,4,12-15H2,1-3H3