1-(9-cyclopentyl-9-azabicyclo[3.3.1]nonan-3-yl)-3-(2,5-dimethylphenyl)thiourea

Systemtic Name: 1-(9-cyclopentyl-9-azabicyclo[3.3.1]nonan-3-yl)-3-(2,5-dimethylphenyl)thiourea Openeye Name: 1-(9-cyclopentyl-9-azabicyclo[3.3.1]nonan-3-yl)-3-(2,5-dimethylphenyl)thiourea CAS Name: 1-(9-cyclopentyl-9-azabicyclo[3.3.1]nonan-3-yl)-3-(2,5-dimethylphenyl)thiourea IUPAC Name: 1-(9-cyclopentyl-9-azabicyclo[3.3.1]nonan-3-yl)-3-(2,5-dimethylphenyl)thiourea Traditional Name: 1-(9-cyclopentyl-9-azabicyclo[3.3.1]nonan-3-yl)-3-(2,5-dimethylphenyl)thiourea Formula: C22H33N3S MolecularWeight: 371.58252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)NC2CC3CCCC(C2)N3C4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)NC2CC3CCCC(C2)N3C4CCCC4

InChI

InChI=1S/C22H33N3S/c1-15-10-11-16(2)21(12-15)24-22(26)23-17-13-19-8-5-9-20(14-17)25(19)18-6-3-4-7-18/h10-12,17-20H,3-9,13-14H2,1-2H3,(H2,23,24,26)