2-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-3-[4-(phenylcarbonyl)phenyl]propanenitrile

Systemtic Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-3-[4-(phenylcarbonyl)phenyl]propanenitrile Openeye Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(4-benzoylphenyl)-3-oxo-propanenitrile CAS Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(4-benzoylphenyl)-3-oxopropanenitrile IUPAC Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(4-benzoylphenyl)-3-oxopropanenitrile Traditional Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-(4-benzoylphenyl)-3-keto-propionitrile Formula: C23H14N2O2S MolecularWeight: 382.43446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)C(=C3NC4=CC=CC=C4S3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)C(=C3NC4=CC=CC=C4S3)C#N

InChI

InChI=1S/C23H14N2O2S/c24-14-18(23-25-19-8-4-5-9-20(19)28-23)22(27)17-12-10-16(11-13-17)21(26)15-6-2-1-3-7-15/h1-13,25H