3-(2-ethylphenyl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 3-(2-ethylphenyl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 3-(2-ethylphenyl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1-(2-thienylmethyl)thiourea CAS Name: 3-(2-ethylphenyl)-1-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 3-(2-ethylphenyl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 3-(2-ethylphenyl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1-(2-thenyl)thiourea Formula: C23H34N3S2+ MolecularWeight: 416.66616

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CC2=CC=CS2)C3CC([NH2+]C(C3)(C)C)(C)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CC2=CC=CS2)C3CC([NH2+]C(C3)(C)C)(C)C

InChI

InChI=1S/C23H33N3S2/c1-6-17-10-7-8-12-20(17)24-21(27)26(16-19-11-9-13-28-19)18-14-22(2,3)25-23(4,5)15-18/h7-13,18,25H,6,14-16H2,1-5H3,(H,24,27)/p+1