2-(2-phenyl-3H-1,3-benzothiazol-2-yl)ethanenitrile

Systemtic Name: 2-(2-phenyl-3H-1,3-benzothiazol-2-yl)ethanenitrile Openeye Name: 2-(2-phenyl-3H-1,3-benzothiazol-2-yl)acetonitrile CAS Name: 2-(2-phenyl-3H-1,3-benzothiazol-2-yl)acetonitrile IUPAC Name: 2-(2-phenyl-3H-1,3-benzothiazol-2-yl)acetonitrile Traditional Name: 2-(2-phenyl-3H-1,3-benzothiazol-2-yl)acetonitrile Formula: C15H12N2S MolecularWeight: 252.33418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(NC3=CC=CC=C3S2)CC#N

Isomeric SMILES

C1=CC=C(C=C1)C2(NC3=CC=CC=C3S2)CC#N

InChI

InChI=1S/C15H12N2S/c16-11-10-15(12-6-2-1-3-7-12)17-13-8-4-5-9-14(13)18-15/h1-9,17H,10H2