1-(2-cyanoethyl)-3-(furan-2-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(furan-2-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-(2-cyanoethyl)-3-(2-furylmethyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-(2-cyanoethyl)-3-(2-furanylmethyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-(2-cyanoethyl)-3-(furan-2-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(2-cyanoethyl)-3-(2-furfuryl)-1-(3-pyridylmethyl)thiourea Formula: C15H16N4OS MolecularWeight: 300.37874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN(CCC#N)C(=S)NCC2=CC=CO2

Isomeric SMILES

C1=CC(=CN=C1)CN(CCC#N)C(=S)NCC2=CC=CO2

InChI

InChI=1S/C15H16N4OS/c16-6-3-8-19(12-13-4-1-7-17-10-13)15(21)18-11-14-5-2-9-20-14/h1-2,4-5,7,9-10H,3,8,11-12H2,(H,18,21)