2-[6-oxidanyl-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzothiazol-4-yl]ethanenitrile

Systemtic Name: 2-[6-oxidanyl-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzothiazol-4-yl]ethanenitrile Openeye Name: 2-[6-hydroxy-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzothiazol-4-yl]acetonitrile CAS Name: 2-[6-hydroxy-2-(4-oxo-1-cyclohexa-2,5-dienylidene)-3H-1,3-benzothiazol-4-yl]acetonitrile IUPAC Name: 2-[6-hydroxy-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzothiazol-4-yl]acetonitrile Traditional Name: 2-[6-hydroxy-2-(4-ketocyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzothiazol-4-yl]acetonitrile Formula: C15H10N2O2S MolecularWeight: 282.3171

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=C2NC3=C(S2)C=C(C=C3CC#N)O

Isomeric SMILES

C1=CC(=O)C=CC1=C2NC3=C(S2)C=C(C=C3CC#N)O

InChI

InChI=1S/C15H10N2O2S/c16-6-5-10-7-12(19)8-13-14(10)17-15(20-13)9-1-3-11(18)4-2-9/h1-4,7-8,17,19H,5H2