N-[4-(1,4-diazepan-1-ylcarbonyl)-2-methyl-phenyl]furan-2-carboxamide

Systemtic Name: N-[4-(1,4-diazepan-1-ylcarbonyl)-2-methyl-phenyl]furan-2-carboxamide Openeye Name: N-[4-(1,4-diazepane-1-carbonyl)-2-methyl-phenyl]furan-2-carboxamide CAS Name: N-[4-[1,4-diazepan-1-yl(oxo)methyl]-2-methylphenyl]-2-furancarboxamide IUPAC Name: N-[4-(1,4-diazepane-1-carbonyl)-2-methylphenyl]furan-2-carboxamide Traditional Name: N-[4-(1,4-diazepane-1-carbonyl)-2-methyl-phenyl]-2-furamide Formula: C18H21N3O3 MolecularWeight: 327.37764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCCNCC2)NC(=O)C3=CC=CO3

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCCNCC2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C18H21N3O3/c1-13-12-14(18(23)21-9-3-7-19-8-10-21)5-6-15(13)20-17(22)16-4-2-11-24-16/h2,4-6,11-12,19H,3,7-10H2,1H3,(H,20,22)