N-(furan-2-ylmethyl)-6-methyl-5-nitro-2-(4-phenylpiperazin-1-yl)pyrimidin-4-amine

Systemtic Name: N-(furan-2-ylmethyl)-6-methyl-5-nitro-2-(4-phenylpiperazin-1-yl)pyrimidin-4-amine Openeye Name: N-(2-furylmethyl)-6-methyl-5-nitro-2-(4-phenylpiperazin-1-yl)pyrimidin-4-amine CAS Name: N-(2-furanylmethyl)-6-methyl-5-nitro-2-(4-phenyl-1-piperazinyl)-4-pyrimidinamine IUPAC Name: N-(furan-2-ylmethyl)-6-methyl-5-nitro-2-(4-phenylpiperazin-1-yl)pyrimidin-4-amine Traditional Name: 2-furfuryl-[6-methyl-5-nitro-2-(4-phenylpiperazino)pyrimidin-4-yl]amine Formula: C20H22N6O3 MolecularWeight: 394.42708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)N2CCN(CC2)C3=CC=CC=C3)NCC4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)N2CCN(CC2)C3=CC=CC=C3)NCC4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N6O3/c1-15-18(26(27)28)19(21-14-17-8-5-13-29-17)23-20(22-15)25-11-9-24(10-12-25)16-6-3-2-4-7-16/h2-8,13H,9-12,14H2,1H3,(H,21,22,23)