4-(4-ethynyl-6-oxidanyl-3H-1,3-benzothiazol-2-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(4-ethynyl-6-oxidanyl-3H-1,3-benzothiazol-2-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-(4-ethynyl-6-hydroxy-3H-1,3-benzothiazol-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-(4-ethynyl-6-hydroxy-3H-1,3-benzothiazol-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(4-ethynyl-6-hydroxy-3H-1,3-benzothiazol-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-(4-ethynyl-6-hydroxy-3H-1,3-benzothiazol-2-ylidene)cyclohexa-2,5-dien-1-one Formula: C15H9NO2S MolecularWeight: 267.30246

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC2=C1NC(=C3C=CC(=O)C=C3)S2)O

Isomeric SMILES

C#CC1=CC(=CC2=C1NC(=C3C=CC(=O)C=C3)S2)O

InChI

InChI=1S/C15H9NO2S/c1-2-9-7-12(18)8-13-14(9)16-15(19-13)10-3-5-11(17)6-4-10/h1,3-8,16,18H