(4Z)-7-chloranyl-1,1-bis(oxidanylidene)-4-[oxidanyl-(2-pyridin-2-ylhydrazinyl)methylidene]-2,3-dihydro-1$l^{6}-benzothiepin-5-one

Systemtic Name: (4Z)-7-chloranyl-1,1-bis(oxidanylidene)-4-[oxidanyl-(2-pyridin-2-ylhydrazinyl)methylidene]-2,3-dihydro-1$l^{6}-benzothiepin-5-one Openeye Name: (4Z)-7-chloro-4-[hydroxy-[2-(2-pyridyl)hydrazino]methylene]-1,1-dioxo-2,3-dihydro-1$l^{6}-benzothiepin-5-one CAS Name: (4Z)-7-chloro-4-[hydroxy-(2-pyridinylhydrazo)methylidene]-1,1-dioxo-2,3-dihydro-1$l^{6}-benzothiepin-5-one IUPAC Name: (4Z)-7-chloro-4-[hydroxy-(2-pyridin-2-ylhydrazinyl)methylidene]-1,1-dioxo-2,3-dihydro-1$l^{6}-benzothiepin-5-one Traditional Name: (4Z)-7-chloro-4-[hydroxy-[N'-(2-pyridyl)hydrazino]methylene]-1,1-diketo-2,3-dihydro-1$l^{6}-benzothiepin-5-one Formula: C16H14ClN3O4S MolecularWeight: 379.81806

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)C2=C(C=C(C=C2)Cl)C(=O)C1=C(NNC3=CC=CC=N3)O

Isomeric SMILES

C\1CS(=O)(=O)C2=C(C=C(C=C2)Cl)C(=O)/C1=C(/NNC3=CC=CC=N3)\O

InChI

InChI=1S/C16H14ClN3O4S/c17-10-4-5-13-12(9-10)15(21)11(6-8-25(13,23)24)16(22)20-19-14-3-1-2-7-18-14/h1-5,7,9,20,22H,6,8H2,(H,18,19)/b16-11-