3-[5-(3-carbamimidoylphenyl)furan-2-yl]benzenecarboximidamide; N,N-dimethylbutan-1-amine

Systemtic Name: 3-[5-(3-carbamimidoylphenyl)furan-2-yl]benzenecarboximidamide; N,N-dimethylbutan-1-amine Openeye Name: 3-[5-(3-carbamimidoylphenyl)-2-furyl]benzamidine; N,N-dimethylbutan-1-amine CAS Name: 3-[5-(3-carbamimidoylphenyl)-2-furanyl]benzenecarboximidamide; N,N-dimethyl-1-butanamine IUPAC Name: 3-[5-(3-carbamimidoylphenyl)furan-2-yl]benzenecarboximidamide; N,N-dimethylbutan-1-amine Traditional Name: 3-[5-(3-amidinophenyl)-2-furyl]benzamidine; butyl(dimethyl)amine Formula: C24H31N5O MolecularWeight: 405.53584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C.C1=CC(=CC(=C1)C(=N)N)C2=CC=C(O2)C3=CC(=CC=C3)C(=N)N

Isomeric SMILES

CCCCN(C)C.C1=CC(=CC(=C1)C(=N)N)C2=CC=C(O2)C3=CC(=CC=C3)C(=N)N

InChI

InChI=1S/C18H16N4O.C6H15N/c19-17(20)13-5-1-3-11(9-13)15-7-8-16(23-15)12-4-2-6-14(10-12)18(21)22;1-4-5-6-7(2)3/h1-10H,(H3,19,20)(H3,21,22);4-6H2,1-3H3