6-ethyl-2,3-bis(oxidanyl)-9-thiophen-2-yl-6H-benzo[b][1]benzothiepin-5-one

Systemtic Name: 6-ethyl-2,3-bis(oxidanyl)-9-thiophen-2-yl-6H-benzo[b][1]benzothiepin-5-one Openeye Name: 6-ethyl-2,3-dihydroxy-9-(2-thienyl)-6H-benzo[b][1]benzothiepin-5-one CAS Name: 6-ethyl-2,3-dihydroxy-9-thiophen-2-yl-6H-benzo[b][1]benzothiepin-5-one IUPAC Name: 6-ethyl-2,3-dihydroxy-9-thiophen-2-yl-6H-benzo[b][1]benzothiepin-5-one Traditional Name: 6-ethyl-2,3-dihydroxy-9-(2-thienyl)-6H-benzo[b][1]benzothiepin-5-one Formula: C20H16O3S2 MolecularWeight: 368.46924

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(C=C(C=C2)C3=CC=CS3)SC4=CC(=C(C=C4C1=O)O)O

Isomeric SMILES

CCC1C2=C(C=C(C=C2)C3=CC=CS3)SC4=CC(=C(C=C4C1=O)O)O

InChI

InChI=1S/C20H16O3S2/c1-2-12-13-6-5-11(17-4-3-7-24-17)8-18(13)25-19-10-16(22)15(21)9-14(19)20(12)23/h3-10,12,21-22H,2H2,1H3