2-(1,3-benzothiazol-2-yl)-2-(2-phenylquinazolin-4-yl)ethanenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-2-(2-phenylquinazolin-4-yl)ethanenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-2-(2-phenylquinazolin-4-yl)acetonitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-2-(2-phenyl-4-quinazolinyl)acetonitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-2-(2-phenylquinazolin-4-yl)acetonitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-(2-phenylquinazolin-4-yl)acetonitrile Formula: C23H14N4S MolecularWeight: 378.44906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)C(C#N)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)C(C#N)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H14N4S/c24-14-17(23-26-19-12-6-7-13-20(19)28-23)21-16-10-4-5-11-18(16)25-22(27-21)15-8-2-1-3-9-15/h1-13,17H