3-cyclooctyl-1-[[4-(diethylamino)phenyl]methyl]-1-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 3-cyclooctyl-1-[[4-(diethylamino)phenyl]methyl]-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 3-cyclooctyl-1-[[4-(diethylamino)phenyl]methyl]-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 3-cyclooctyl-1-[[4-(diethylamino)phenyl]methyl]-1-(2-oxolanylmethyl)thiourea IUPAC Name: 3-cyclooctyl-1-[[4-(diethylamino)phenyl]methyl]-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-cyclooctyl-1-[4-(diethylamino)benzyl]-1-(tetrahydrofurfuryl)thiourea Formula: C25H41N3OS MolecularWeight: 431.67754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)CN(CC2CCCO2)C(=S)NC3CCCCCCC3

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)CN(CC2CCCO2)C(=S)NC3CCCCCCC3

InChI

InChI=1S/C25H41N3OS/c1-3-27(4-2)23-16-14-21(15-17-23)19-28(20-24-13-10-18-29-24)25(30)26-22-11-8-6-5-7-9-12-22/h14-17,22,24H,3-13,18-20H2,1-2H3,(H,26,30)