3-cyclooctyl-1-[(5-methylfuran-2-yl)methyl]-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-cyclooctyl-1-[(5-methylfuran-2-yl)methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-cyclooctyl-1-[(5-methyl-2-furyl)methyl]-1-(3-pyridylmethyl)thiourea CAS Name: 3-cyclooctyl-1-[(5-methyl-2-furanyl)methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-cyclooctyl-1-[(5-methylfuran-2-yl)methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-cyclooctyl-1-[(5-methyl-2-furyl)methyl]-1-(3-pyridylmethyl)thiourea Formula: C21H29N3OS MolecularWeight: 371.53946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(CC2=CN=CC=C2)C(=S)NC3CCCCCCC3

Isomeric SMILES

CC1=CC=C(O1)CN(CC2=CN=CC=C2)C(=S)NC3CCCCCCC3

InChI

InChI=1S/C21H29N3OS/c1-17-11-12-20(25-17)16-24(15-18-8-7-13-22-14-18)21(26)23-19-9-5-3-2-4-6-10-19/h7-8,11-14,19H,2-6,9-10,15-16H2,1H3,(H,23,26)