1-[(5-ethylthiophen-2-yl)-(furan-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-ethylthiophen-2-yl)-(furan-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(5-ethyl-2-thienyl)-(2-furyl)methyl]-1,4-diazepane CAS Name: 1-[(5-ethyl-2-thiophenyl)-(2-furanyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-ethylthiophen-2-yl)-(furan-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(5-ethyl-2-thienyl)-(2-furyl)methyl]-1,4-diazepane Formula: C16H22N2OS MolecularWeight: 290.42368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(C2=CC=CO2)N3CCCNCC3

Isomeric SMILES

CCC1=CC=C(S1)C(C2=CC=CO2)N3CCCNCC3

InChI

InChI=1S/C16H22N2OS/c1-2-13-6-7-15(20-13)16(14-5-3-12-19-14)18-10-4-8-17-9-11-18/h3,5-7,12,16-17H,2,4,8-11H2,1H3