1-(4-butoxyphenyl)-3-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]urea

Systemtic Name: 1-(4-butoxyphenyl)-3-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]urea Openeye Name: 1-(4-butoxyphenyl)-3-[2-[1-(2-thienylsulfonyl)-2-piperidyl]ethyl]urea CAS Name: 1-(4-butoxyphenyl)-3-[2-(1-thiophen-2-ylsulfonyl-2-piperidinyl)ethyl]urea IUPAC Name: 1-(4-butoxyphenyl)-3-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]urea Traditional Name: 1-(4-butoxyphenyl)-3-[2-[1-(2-thienylsulfonyl)-2-piperidyl]ethyl]urea Formula: C22H31N3O4S2 MolecularWeight: 465.62924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)NCCC2CCCCN2S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)NCCC2CCCCN2S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C22H31N3O4S2/c1-2-3-16-29-20-11-9-18(10-12-20)24-22(26)23-14-13-19-7-4-5-15-25(19)31(27,28)21-8-6-17-30-21/h6,8-12,17,19H,2-5,7,13-16H2,1H3,(H2,23,24,26)