4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-2-phenyl-5-sulfanyl-1,2-thiazol-3-one

Systemtic Name: 4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-2-phenyl-5-sulfanyl-1,2-thiazol-3-one Openeye Name: 4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-phenyl-5-sulfanyl-isothiazol-3-one CAS Name: 5-mercapto-4-[(4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-2-phenyl-3-isothiazolone IUPAC Name: 4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-phenyl-5-sulfanyl-1,2-thiazol-3-one Traditional Name: 4-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-5-mercapto-2-phenyl-4-isothiazolin-3-one Formula: C16H11NO2S2 MolecularWeight: 313.39404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=C(S2)S)C=C3C=CC(=O)C=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=C(S2)S)C=C3C=CC(=O)C=C3

InChI

InChI=1S/C16H11NO2S2/c18-13-8-6-11(7-9-13)10-14-15(19)17(21-16(14)20)12-4-2-1-3-5-12/h1-10,20H