3-[5,5-bis(oxidanylidene)dibenzothiophen-2-yl]-1-methyl-1-(2-pyridin-4-ylethyl)urea

Systemtic Name: 3-[5,5-bis(oxidanylidene)dibenzothiophen-2-yl]-1-methyl-1-(2-pyridin-4-ylethyl)urea Openeye Name: 3-(5,5-dioxodibenzothiophen-2-yl)-1-methyl-1-[2-(4-pyridyl)ethyl]urea CAS Name: 3-(5,5-dioxo-2-dibenzothiophenyl)-1-methyl-1-(2-pyridin-4-ylethyl)urea IUPAC Name: 3-(5,5-dioxodibenzothiophen-2-yl)-1-methyl-1-(2-pyridin-4-ylethyl)urea Traditional Name: 3-(5,5-diketodibenzothiophen-2-yl)-1-methyl-1-[2-(4-pyridyl)ethyl]urea Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=NC=C1)C(=O)NC2=CC3=C(C=C2)S(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CN(CCC1=CC=NC=C1)C(=O)NC2=CC3=C(C=C2)S(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H19N3O3S/c1-24(13-10-15-8-11-22-12-9-15)21(25)23-16-6-7-20-18(14-16)17-4-2-3-5-19(17)28(20,26)27/h2-9,11-12,14H,10,13H2,1H3,(H,23,25)