3-(2-methoxyphenyl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1-(thiophen-2-ylmethyl)urea

Systemtic Name: 3-(2-methoxyphenyl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1-(thiophen-2-ylmethyl)urea Openeye Name: 3-(2-methoxyphenyl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1-(2-thienylmethyl)urea CAS Name: 3-(2-methoxyphenyl)-1-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-1-(thiophen-2-ylmethyl)urea IUPAC Name: 3-(2-methoxyphenyl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1-(thiophen-2-ylmethyl)urea Traditional Name: 3-(2-methoxyphenyl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1-(2-thenyl)urea Formula: C22H32N3O2S+ MolecularWeight: 402.57338

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)N(CC2=CC=CS2)C(=O)NC3=CC=CC=C3OC)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)N(CC2=CC=CS2)C(=O)NC3=CC=CC=C3OC)C

InChI

InChI=1S/C22H31N3O2S/c1-21(2)13-16(14-22(3,4)24-21)25(15-17-9-8-12-28-17)20(26)23-18-10-6-7-11-19(18)27-5/h6-12,16,24H,13-15H2,1-5H3,(H,23,26)/p+1