1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylphenyl)sulfonyl-1-(pyridin-2-ylmethyl)urea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylphenyl)sulfonyl-1-(pyridin-2-ylmethyl)urea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(p-tolylsulfonyl)-1-(2-pyridylmethyl)urea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylphenyl)sulfonyl-1-(2-pyridinylmethyl)urea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylphenyl)sulfonyl-1-(pyridin-2-ylmethyl)urea Traditional Name: 1-piperonyl-1-(2-pyridylmethyl)-3-tosyl-urea Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CC=N4

InChI

InChI=1S/C22H21N3O5S/c1-16-5-8-19(9-6-16)31(27,28)24-22(26)25(14-18-4-2-3-11-23-18)13-17-7-10-20-21(12-17)30-15-29-20/h2-12H,13-15H2,1H3,(H,24,26)