10,10-bis(oxidanylidene)-N1,N9-bis(2-thiophen-2-ylethyl)phenoxathiine-1,9-dicarboxamide

Systemtic Name: 10,10-bis(oxidanylidene)-N1,N9-bis(2-thiophen-2-ylethyl)phenoxathiine-1,9-dicarboxamide Openeye Name: 10,10-dioxo-N1,N9-bis[2-(2-thienyl)ethyl]phenoxathiine-1,9-dicarboxamide CAS Name: 10,10-dioxo-N1,N9-bis(2-thiophen-2-ylethyl)phenoxathiine-1,9-dicarboxamide IUPAC Name: 10,10-dioxo-1-N,9-N-bis(2-thiophen-2-ylethyl)phenoxathiine-1,9-dicarboxamide Traditional Name: 10,10-diketo-N,N'-bis[2-(2-thienyl)ethyl]phenoxathiine-1,9-dicarboxamide Formula: C26H22N2O5S3 MolecularWeight: 538.65828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)OC3=CC=CC(=C3S2(=O)=O)C(=O)NCCC4=CC=CS4)C(=O)NCCC5=CC=CS5

Isomeric SMILES

C1=CC(=C2C(=C1)OC3=CC=CC(=C3S2(=O)=O)C(=O)NCCC4=CC=CS4)C(=O)NCCC5=CC=CS5

InChI

InChI=1S/C26H22N2O5S3/c29-25(27-13-11-17-5-3-15-34-17)19-7-1-9-21-23(19)36(31,32)24-20(8-2-10-22(24)33-21)26(30)28-14-12-18-6-4-16-35-18/h1-10,15-16H,11-14H2,(H,27,29)(H,28,30)