1-(4-azidosulfonylphenyl)-3-[[4-oxidanyl-3,3-bis(phenylmethyl)cyclohexa-1,4-dien-1-yl]methyl]urea

Systemtic Name: 1-(4-azidosulfonylphenyl)-3-[[4-oxidanyl-3,3-bis(phenylmethyl)cyclohexa-1,4-dien-1-yl]methyl]urea Openeye Name: 1-(4-azidosulfonylphenyl)-3-[(3,3-dibenzyl-4-hydroxy-cyclohexa-1,4-dien-1-yl)methyl]urea CAS Name: 1-(4-azidosulfonylphenyl)-3-[[4-hydroxy-3,3-bis(phenylmethyl)-1-cyclohexa-1,4-dienyl]methyl]urea IUPAC Name: 1-(4-azidosulfonylphenyl)-3-[(3,3-dibenzyl-4-hydroxycyclohexa-1,4-dien-1-yl)methyl]urea Traditional Name: 1-(4-azidosulfonylphenyl)-3-[(3,3-dibenzyl-4-hydroxy-cyclohexa-1,4-dien-1-yl)methyl]urea Formula: C28H27N5O4S MolecularWeight: 529.61008

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C(C=C1CNC(=O)NC2=CC=C(C=C2)S(=O)(=O)N=[N+]=[N-])(CC3=CC=CC=C3)CC4=CC=CC=C4)O

Isomeric SMILES

C1C=C(C(C=C1CNC(=O)NC2=CC=C(C=C2)S(=O)(=O)N=[N+]=[N-])(CC3=CC=CC=C3)CC4=CC=CC=C4)O

InChI

InChI=1S/C28H27N5O4S/c29-32-33-38(36,37)25-14-12-24(13-15-25)31-27(35)30-20-23-11-16-26(34)28(19-23,17-21-7-3-1-4-8-21)18-22-9-5-2-6-10-22/h1-10,12-16,19,34H,11,17-18,20H2,(H2,30,31,35)