1-methyl-3-[9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl]thiourea

Systemtic Name: 1-methyl-3-[9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl]thiourea Openeye Name: 1-methyl-3-[9-(p-tolylmethyl)-9-azabicyclo[3.3.1]nonan-3-yl]thiourea CAS Name: 1-methyl-3-[9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl]thiourea IUPAC Name: 1-methyl-3-[9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl]thiourea Traditional Name: 1-methyl-3-[9-(4-methylbenzyl)-9-azabicyclo[3.3.1]nonan-3-yl]thiourea Formula: C18H27N3S MolecularWeight: 317.49208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3CCCC2CC(C3)NC(=S)NC

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3CCCC2CC(C3)NC(=S)NC

InChI

InChI=1S/C18H27N3S/c1-13-6-8-14(9-7-13)12-21-16-4-3-5-17(21)11-15(10-16)20-18(22)19-2/h6-9,15-17H,3-5,10-12H2,1-2H3,(H2,19,20,22)