2-[(6S)-6-phenyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]ethanenitrile

Systemtic Name: 2-[(6S)-6-phenyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]ethanenitrile Openeye Name: 2-[(6S)-6-phenyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetonitrile CAS Name: 2-[(6S)-6-phenyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetonitrile IUPAC Name: 2-[(6S)-6-phenyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetonitrile Traditional Name: 2-[(6S)-6-phenyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetonitrile Formula: C15H14N2S MolecularWeight: 254.35006

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1C3=CC=CC=C3)SC(=N2)CC#N

Isomeric SMILES

C1CC2=C(C[C@H]1C3=CC=CC=C3)SC(=N2)CC#N

InChI

InChI=1S/C15H14N2S/c16-9-8-15-17-13-7-6-12(10-14(13)18-15)11-4-2-1-3-5-11/h1-5,12H,6-8,10H2/t12-/m0/s1