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

Systemtic Name: 1-(9-cyclohexyl-9-azabicyclo[3.3.1]nonan-3-yl)-3-(2,5-dimethylphenyl)thiourea Openeye Name: 1-(9-cyclohexyl-9-azabicyclo[3.3.1]nonan-3-yl)-3-(2,5-dimethylphenyl)thiourea CAS Name: 1-(9-cyclohexyl-9-azabicyclo[3.3.1]nonan-3-yl)-3-(2,5-dimethylphenyl)thiourea IUPAC Name: 1-(9-cyclohexyl-9-azabicyclo[3.3.1]nonan-3-yl)-3-(2,5-dimethylphenyl)thiourea Traditional Name: 1-(9-cyclohexyl-9-azabicyclo[3.3.1]nonan-3-yl)-3-(2,5-dimethylphenyl)thiourea Formula: C23H35N3S MolecularWeight: 385.6091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)NC2CC3CCCC(C2)N3C4CCCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)NC2CC3CCCC(C2)N3C4CCCCC4

InChI

InChI=1S/C23H35N3S/c1-16-11-12-17(2)22(13-16)25-23(27)24-18-14-20-9-6-10-21(15-18)26(20)19-7-4-3-5-8-19/h11-13,18-21H,3-10,14-15H2,1-2H3,(H2,24,25,27)