3-cycloheptyl-1-[(4-methoxyphenyl)methyl]-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thiourea

Systemtic Name: 3-cycloheptyl-1-[(4-methoxyphenyl)methyl]-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thiourea Openeye Name: 3-cycloheptyl-1-[(4-methoxyphenyl)methyl]-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thiourea CAS Name: 3-cycloheptyl-1-[(4-methoxyphenyl)methyl]-1-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)thiourea IUPAC Name: 3-cycloheptyl-1-[(4-methoxyphenyl)methyl]-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thiourea Traditional Name: 3-cycloheptyl-1-p-anisyl-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thiourea Formula: C25H42N3OS+ MolecularWeight: 432.68548

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)N(CC2=CC=C(C=C2)OC)C(=S)NC3CCCCCC3)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)N(CC2=CC=C(C=C2)OC)C(=S)NC3CCCCCC3)C

InChI

InChI=1S/C25H41N3OS/c1-24(2)16-21(17-25(3,4)27-24)28(18-19-12-14-22(29-5)15-13-19)23(30)26-20-10-8-6-7-9-11-20/h12-15,20-21,27H,6-11,16-18H2,1-5H3,(H,26,30)/p+1