1-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-3-(furan-3-ylmethyl)urea

Systemtic Name: 1-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-3-(furan-3-ylmethyl)urea Openeye Name: 1-[[6-(azepan-1-yl)-3-pyridyl]methyl]-3-(3-furylmethyl)urea CAS Name: 1-[[6-(1-azepanyl)-3-pyridinyl]methyl]-3-(3-furanylmethyl)urea IUPAC Name: 1-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-3-(furan-3-ylmethyl)urea Traditional Name: 1-[[6-(azepan-1-yl)-3-pyridyl]methyl]-3-(3-furfuryl)urea Formula: C18H24N4O2 MolecularWeight: 328.40876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)NCC3=COC=C3

Isomeric SMILES

C1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)NCC3=COC=C3

InChI

InChI=1S/C18H24N4O2/c23-18(21-13-16-7-10-24-14-16)20-12-15-5-6-17(19-11-15)22-8-3-1-2-4-9-22/h5-7,10-11,14H,1-4,8-9,12-13H2,(H2,20,21,23)