3-[4-[5-(2,6-dimethylpiperazin-1-yl)pentyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]benzenecarboximidamide

Systemtic Name: 3-[4-[5-(2,6-dimethylpiperazin-1-yl)pentyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]benzenecarboximidamide Openeye Name: 3-[4-[5-(2,6-dimethylpiperazin-1-yl)pentyl]-3-oxo-1,4-benzoxazin-2-yl]benzamidine CAS Name: 3-[4-[5-(2,6-dimethyl-1-piperazinyl)pentyl]-3-oxo-1,4-benzoxazin-2-yl]benzenecarboximidamide IUPAC Name: 3-[4-[5-(2,6-dimethylpiperazin-1-yl)pentyl]-3-oxo-1,4-benzoxazin-2-yl]benzenecarboximidamide Traditional Name: 3-[4-[5-(2,6-dimethylpiperazino)pentyl]-3-keto-1,4-benzoxazin-2-yl]benzamidine Formula: C26H35N5O2 MolecularWeight: 449.5884

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCC(N1CCCCCN2C3=CC=CC=C3OC(C2=O)C4=CC=CC(=C4)C(=N)N)C

Isomeric SMILES

CC1CNCC(N1CCCCCN2C3=CC=CC=C3OC(C2=O)C4=CC=CC(=C4)C(=N)N)C

InChI

InChI=1S/C26H35N5O2/c1-18-16-29-17-19(2)30(18)13-6-3-7-14-31-22-11-4-5-12-23(22)33-24(26(31)32)20-9-8-10-21(15-20)25(27)28/h4-5,8-12,15,18-19,24,29H,3,6-7,13-14,16-17H2,1-2H3,(H3,27,28)