1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-(furan-2-ylmethyl)-1,4-diazepane

Systemtic Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-(furan-2-ylmethyl)-1,4-diazepane Openeye Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-(2-furylmethyl)-1,4-diazepane CAS Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-(2-furanylmethyl)-1,4-diazepane IUPAC Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-(furan-2-ylmethyl)-1,4-diazepane Traditional Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-(2-furfuryl)-1,4-diazepane Formula: C17H26N4O MolecularWeight: 302.41454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1)C)CN2CCCN(CC2)CC3=CC=CO3

Isomeric SMILES

CCC1=NC(=C(N1)C)CN2CCCN(CC2)CC3=CC=CO3

InChI

InChI=1S/C17H26N4O/c1-3-17-18-14(2)16(19-17)13-21-8-5-7-20(9-10-21)12-15-6-4-11-22-15/h4,6,11H,3,5,7-10,12-13H2,1-2H3,(H,18,19)