furan-2-yl-[4-[6-[(2-hydroxyphenyl)methyl-methyl-amino]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: furan-2-yl-[4-[6-[(2-hydroxyphenyl)methyl-methyl-amino]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: 2-furyl-[4-[6-[(2-hydroxyphenyl)methyl-methyl-amino]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: 2-furanyl-[4-[6-[(2-hydroxyphenyl)methyl-methylamino]-5-nitro-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: furan-2-yl-[4-[6-[(2-hydroxyphenyl)methyl-methylamino]-5-nitropyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: 2-furyl-[4-[6-[methyl(salicyl)amino]-5-nitro-pyrimidin-4-yl]piperazino]methanone Formula: C21H22N6O5 MolecularWeight: 438.43658

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1O)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CN(CC1=CC=CC=C1O)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C21H22N6O5/c1-24(13-15-5-2-3-6-16(15)28)19-18(27(30)31)20(23-14-22-19)25-8-10-26(11-9-25)21(29)17-7-4-12-32-17/h2-7,12,14,28H,8-11,13H2,1H3