3-[3-oxidanylidene-4-(5-piperazin-1-ylpentyl)-1,4-benzoxazin-2-yl]benzenecarboximidamide

Systemtic Name: 3-[3-oxidanylidene-4-(5-piperazin-1-ylpentyl)-1,4-benzoxazin-2-yl]benzenecarboximidamide Openeye Name: 3-[3-oxo-4-(5-piperazin-1-ylpentyl)-1,4-benzoxazin-2-yl]benzamidine CAS Name: 3-[3-oxo-4-[5-(1-piperazinyl)pentyl]-1,4-benzoxazin-2-yl]benzenecarboximidamide IUPAC Name: 3-[3-oxo-4-(5-piperazin-1-ylpentyl)-1,4-benzoxazin-2-yl]benzenecarboximidamide Traditional Name: 3-[3-keto-4-(5-piperazinopentyl)-1,4-benzoxazin-2-yl]benzamidine Formula: C24H31N5O2 MolecularWeight: 421.53524

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCCCCN2C3=CC=CC=C3OC(C2=O)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1CN(CCN1)CCCCCN2C3=CC=CC=C3OC(C2=O)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C24H31N5O2/c25-23(26)19-8-6-7-18(17-19)22-24(30)29(20-9-2-3-10-21(20)31-22)14-5-1-4-13-28-15-11-27-12-16-28/h2-3,6-10,17,22,27H,1,4-5,11-16H2,(H3,25,26)