4-methoxy-2-[4-(2-nitrophenyl)piperazin-1-yl]-N-(oxolan-2-ylmethyl)pyrimidine-5-carboxamide

Systemtic Name: 4-methoxy-2-[4-(2-nitrophenyl)piperazin-1-yl]-N-(oxolan-2-ylmethyl)pyrimidine-5-carboxamide Openeye Name: 4-methoxy-2-[4-(2-nitrophenyl)piperazin-1-yl]-N-(tetrahydrofuran-2-ylmethyl)pyrimidine-5-carboxamide CAS Name: 4-methoxy-2-[4-(2-nitrophenyl)-1-piperazinyl]-N-(2-oxolanylmethyl)-5-pyrimidinecarboxamide IUPAC Name: 4-methoxy-2-[4-(2-nitrophenyl)piperazin-1-yl]-N-(oxolan-2-ylmethyl)pyrimidine-5-carboxamide Traditional Name: 4-methoxy-2-[4-(2-nitrophenyl)piperazino]-N-(tetrahydrofurfuryl)pyrimidine-5-carboxamide Formula: C21H26N6O5 MolecularWeight: 442.46834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1C(=O)NCC2CCCO2)N3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

COC1=NC(=NC=C1C(=O)NCC2CCCO2)N3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H26N6O5/c1-31-20-16(19(28)22-13-15-5-4-12-32-15)14-23-21(24-20)26-10-8-25(9-11-26)17-6-2-3-7-18(17)27(29)30/h2-3,6-7,14-15H,4-5,8-13H2,1H3,(H,22,28)