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

Systemtic Name: 1-(2-cyanoethyl)-3-cyclohexyl-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-(2-cyanoethyl)-3-cyclohexyl-1-(3-pyridylmethyl)thiourea CAS Name: 1-(2-cyanoethyl)-3-cyclohexyl-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-(2-cyanoethyl)-3-cyclohexyl-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(2-cyanoethyl)-3-cyclohexyl-1-(3-pyridylmethyl)thiourea Formula: C16H22N4S MolecularWeight: 302.43768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)N(CCC#N)CC2=CN=CC=C2

Isomeric SMILES

C1CCC(CC1)NC(=S)N(CCC#N)CC2=CN=CC=C2

InChI

InChI=1S/C16H22N4S/c17-9-5-11-20(13-14-6-4-10-18-12-14)16(21)19-15-7-2-1-3-8-15/h4,6,10,12,15H,1-3,5,7-8,11,13H2,(H,19,21)