1-azanyl-N-(3-imidazol-1-ylbutyl)-3-methyl-cyclohexa-2,4-diene-1-carboxamide

Systemtic Name: 1-azanyl-N-(3-imidazol-1-ylbutyl)-3-methyl-cyclohexa-2,4-diene-1-carboxamide Openeye Name: 1-amino-N-(3-imidazol-1-ylbutyl)-3-methyl-cyclohexa-2,4-diene-1-carboxamide CAS Name: 1-amino-N-[3-(1-imidazolyl)butyl]-3-methyl-1-cyclohexa-2,4-dienecarboxamide IUPAC Name: 1-amino-N-(3-imidazol-1-ylbutyl)-3-methylcyclohexa-2,4-diene-1-carboxamide Traditional Name: 1-amino-N-(3-imidazol-1-ylbutyl)-3-methyl-cyclohexa-2,4-diene-1-carboxamide Formula: C15H22N4O MolecularWeight: 274.36138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(CC=C1)(C(=O)NCCC(C)N2C=CN=C2)N

Isomeric SMILES

CC1=CC(CC=C1)(C(=O)NCCC(C)N2C=CN=C2)N

InChI

InChI=1S/C15H22N4O/c1-12-4-3-6-15(16,10-12)14(20)18-7-5-13(2)19-9-8-17-11-19/h3-4,8-11,13H,5-7,16H2,1-2H3,(H,18,20)