5-(furan-2-ylmethyl)-3-(4-methylpiperazin-1-yl)-6H-pyridazino[3,4-b][1,4]benzoxazepine

Systemtic Name: 5-(furan-2-ylmethyl)-3-(4-methylpiperazin-1-yl)-6H-pyridazino[3,4-b][1,4]benzoxazepine Openeye Name: 5-(2-furylmethyl)-3-(4-methylpiperazin-1-yl)-6H-pyridazino[3,4-b][1,4]benzoxazepine CAS Name: 5-(2-furanylmethyl)-3-(4-methyl-1-piperazinyl)-6H-pyridazino[3,4-b][1,4]benzoxazepine IUPAC Name: 5-(furan-2-ylmethyl)-3-(4-methylpiperazin-1-yl)-6H-pyridazino[3,4-b][1,4]benzoxazepine Traditional Name: 5-(2-furfuryl)-3-(4-methylpiperazino)-6H-pyridazino[3,4-b][1,4]benzoxazepine Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NN=C3C(=C2)N(CC4=CC=CC=C4O3)CC5=CC=CO5

Isomeric SMILES

CN1CCN(CC1)C2=NN=C3C(=C2)N(CC4=CC=CC=C4O3)CC5=CC=CO5

InChI

InChI=1S/C21H23N5O2/c1-24-8-10-25(11-9-24)20-13-18-21(23-22-20)28-19-7-3-2-5-16(19)14-26(18)15-17-6-4-12-27-17/h2-7,12-13H,8-11,14-15H2,1H3