1-(1,3-benzodioxol-5-yl)-3-[2-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]ethyl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]ethyl]urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[2-[1-(p-tolylsulfonyl)-2-piperidyl]ethyl]urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-[1-(4-methylphenyl)sulfonyl-2-piperidinyl]ethyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[2-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]ethyl]urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(1-tosyl-2-piperidyl)ethyl]urea Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2CCNC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2CCNC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H27N3O5S/c1-16-5-8-19(9-6-16)31(27,28)25-13-3-2-4-18(25)11-12-23-22(26)24-17-7-10-20-21(14-17)30-15-29-20/h5-10,14,18H,2-4,11-13,15H2,1H3,(H2,23,24,26)