6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-N-(1-phenylethyl)pyrimidin-4-amine

Systemtic Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-N-(1-phenylethyl)pyrimidin-4-amine Openeye Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-N-(1-phenylethyl)pyrimidin-4-amine CAS Name: 6-[4-(2,3-dimethylphenyl)-1-piperazinyl]-5-nitro-N-(1-phenylethyl)-4-pyrimidinamine IUPAC Name: 6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-N-(1-phenylethyl)pyrimidin-4-amine Traditional Name: [6-[4-(2,3-dimethylphenyl)piperazino]-5-nitro-pyrimidin-4-yl]-(1-phenylethyl)amine Formula: C24H28N6O2 MolecularWeight: 432.51812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C(=NC=N3)NC(C)C4=CC=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C(=NC=N3)NC(C)C4=CC=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C24H28N6O2/c1-17-8-7-11-21(18(17)2)28-12-14-29(15-13-28)24-22(30(31)32)23(25-16-26-24)27-19(3)20-9-5-4-6-10-20/h4-11,16,19H,12-15H2,1-3H3,(H,25,26,27)