1-[2-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]ethyl]-3-phenethyl-urea

Systemtic Name: 1-[2-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]ethyl]-3-phenethyl-urea Openeye Name: 1-phenethyl-3-[2-[1-(p-tolylsulfonyl)-2-piperidyl]ethyl]urea CAS Name: 1-[2-[1-(4-methylphenyl)sulfonyl-2-piperidinyl]ethyl]-3-phenethylurea IUPAC Name: 1-[2-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]ethyl]-3-phenethylurea Traditional Name: 1-phenethyl-3-[2-(1-tosyl-2-piperidyl)ethyl]urea Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2CCNC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2CCNC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O3S/c1-19-10-12-22(13-11-19)30(28,29)26-18-6-5-9-21(26)15-17-25-23(27)24-16-14-20-7-3-2-4-8-20/h2-4,7-8,10-13,21H,5-6,9,14-18H2,1H3,(H2,24,25,27)