6-[4-(2-ethoxyphenyl)piperazin-1-yl]-5-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-4-amine

Systemtic Name: 6-[4-(2-ethoxyphenyl)piperazin-1-yl]-5-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-4-amine Openeye Name: 6-[4-(2-ethoxyphenyl)piperazin-1-yl]-5-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-4-amine CAS Name: 6-[4-(2-ethoxyphenyl)-1-piperazinyl]-5-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]-4-pyrimidinamine IUPAC Name: 6-[4-(2-ethoxyphenyl)piperazin-1-yl]-5-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-4-amine Traditional Name: [5-nitro-6-(4-o-phenetylpiperazino)pyrimidin-4-yl]-(3,4,5-trimethoxybenzyl)amine Formula: C26H32N6O6 MolecularWeight: 524.56888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C3=C(C(=NC=N3)NCC4=CC(=C(C(=C4)OC)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C3=C(C(=NC=N3)NCC4=CC(=C(C(=C4)OC)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C26H32N6O6/c1-5-38-20-9-7-6-8-19(20)30-10-12-31(13-11-30)26-23(32(33)34)25(28-17-29-26)27-16-18-14-21(35-2)24(37-4)22(15-18)36-3/h6-9,14-15,17H,5,10-13,16H2,1-4H3,(H,27,28,29)