butanedioate; 1-butyl-1-(2,6-dimethylphenyl)-3-(N'-methylcarbamimidoyl)urea

Systemtic Name: butanedioate; 1-butyl-1-(2,6-dimethylphenyl)-3-(N'-methylcarbamimidoyl)urea Openeye Name: butanedioate; 1-butyl-1-(2,6-dimethylphenyl)-3-(N'-methylcarbamimidoyl)urea CAS Name: 3-[amino(methylimino)methyl]-1-butyl-1-(2,6-dimethylphenyl)urea; butanedioate IUPAC Name: butanedioate; 1-butyl-1-(2,6-dimethylphenyl)-3-(N'-methylcarbamimidoyl)urea Traditional Name: 1-butyl-1-(2,6-dimethylphenyl)-3-(N'-methylamidino)urea; succinate Formula: C19H28N4O5-2 MolecularWeight: 392.44942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(C=CC=C1C)C)C(=O)NC(=NC)N.C(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCN(C1=C(C=CC=C1C)C)C(=O)NC(=NC)N.C(CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C15H24N4O.C4H6O4/c1-5-6-10-19(15(20)18-14(16)17-4)13-11(2)8-7-9-12(13)3;5-3(6)1-2-4(7)8/h7-9H,5-6,10H2,1-4H3,(H3,16,17,18,20);1-2H2,(H,5,6)(H,7,8)/p-2