2-[5-(2-carbamimidoyl-4-pentyl-phenyl)furan-2-yl]-5-pentyl-benzenecarboximidamide

Systemtic Name: 2-[5-(2-carbamimidoyl-4-pentyl-phenyl)furan-2-yl]-5-pentyl-benzenecarboximidamide Openeye Name: 2-[5-(2-carbamimidoyl-4-pentyl-phenyl)-2-furyl]-5-pentyl-benzamidine CAS Name: 2-[5-(2-carbamimidoyl-4-pentylphenyl)-2-furanyl]-5-pentylbenzenecarboximidamide IUPAC Name: 2-[5-(2-carbamimidoyl-4-pentylphenyl)furan-2-yl]-5-pentylbenzenecarboximidamide Traditional Name: 2-[5-(2-amidino-4-amyl-phenyl)-2-furyl]-5-amyl-benzamidine Formula: C28H36N4O MolecularWeight: 444.61164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)C2=CC=C(O2)C3=C(C=C(C=C3)CCCCC)C(=N)N)C(=N)N

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)C2=CC=C(O2)C3=C(C=C(C=C3)CCCCC)C(=N)N)C(=N)N

InChI

InChI=1S/C28H36N4O/c1-3-5-7-9-19-11-13-21(23(17-19)27(29)30)25-15-16-26(33-25)22-14-12-20(10-8-6-4-2)18-24(22)28(31)32/h11-18H,3-10H2,1-2H3,(H3,29,30)(H3,31,32)