5-[4-methoxy-3-(4-phenoxyphenyl)phenyl]-1,1-bis(oxidanylidene)-1,2,5-thiadiazolidin-3-one

Systemtic Name: 5-[4-methoxy-3-(4-phenoxyphenyl)phenyl]-1,1-bis(oxidanylidene)-1,2,5-thiadiazolidin-3-one Openeye Name: 5-[4-methoxy-3-(4-phenoxyphenyl)phenyl]-1,1-dioxo-1,2,5-thiadiazolidin-3-one CAS Name: 5-[4-methoxy-3-(4-phenoxyphenyl)phenyl]-1,1-dioxo-1,2,5-thiadiazolidin-3-one IUPAC Name: 5-[4-methoxy-3-(4-phenoxyphenyl)phenyl]-1,1-dioxo-1,2,5-thiadiazolidin-3-one Traditional Name: 1,1-diketo-5-[4-methoxy-3-(4-phenoxyphenyl)phenyl]-1,2,5-thiadiazolidin-3-one Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2CC(=O)NS2(=O)=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)N2CC(=O)NS2(=O)=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C21H18N2O5S/c1-27-20-12-9-16(23-14-21(24)22-29(23,25)26)13-19(20)15-7-10-18(11-8-15)28-17-5-3-2-4-6-17/h2-13H,14H2,1H3,(H,22,24)