5-[4-[4-[(E)-1-benzofuran-2-ylmethoxyiminomethyl]phenyl]piperazin-1-yl]-6-methyl-pyrimidine-2,4-diamine

Systemtic Name: 5-[4-[4-[(E)-1-benzofuran-2-ylmethoxyiminomethyl]phenyl]piperazin-1-yl]-6-methyl-pyrimidine-2,4-diamine Openeye Name: 5-[4-[4-[(E)-benzofuran-2-ylmethoxyiminomethyl]phenyl]piperazin-1-yl]-6-methyl-pyrimidine-2,4-diamine CAS Name: 5-[4-[4-[(E)-2-benzofuranylmethoxyiminomethyl]phenyl]-1-piperazinyl]-6-methylpyrimidine-2,4-diamine IUPAC Name: 5-[4-[4-[(E)-1-benzofuran-2-ylmethoxyiminomethyl]phenyl]piperazin-1-yl]-6-methylpyrimidine-2,4-diamine Traditional Name: [2-amino-5-[4-[4-[(E)-benzofuran-2-ylmethyloximinomethyl]phenyl]piperazino]-6-methyl-pyrimidin-4-yl]amine Formula: C25H27N7O2 MolecularWeight: 457.52758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)N)N)N2CCN(CC2)C3=CC=C(C=C3)C=NOCC4=CC5=CC=CC=C5O4

Isomeric SMILES

CC1=C(C(=NC(=N1)N)N)N2CCN(CC2)C3=CC=C(C=C3)/C=N/OCC4=CC5=CC=CC=C5O4

InChI

InChI=1S/C25H27N7O2/c1-17-23(24(26)30-25(27)29-17)32-12-10-31(11-13-32)20-8-6-18(7-9-20)15-28-33-16-21-14-19-4-2-3-5-22(19)34-21/h2-9,14-15H,10-13,16H2,1H3,(H4,26,27,29,30)/b28-15+