2-[(2R)-2-[(2R)-1-phenylsulfanylpropan-2-yl]-2,3-dihydro-1-benzofuran-6-yl]ethanenitrile

Systemtic Name: 2-[(2R)-2-[(2R)-1-phenylsulfanylpropan-2-yl]-2,3-dihydro-1-benzofuran-6-yl]ethanenitrile Openeye Name: 2-[(2R)-2-[(1R)-1-methyl-2-phenylsulfanyl-ethyl]-2,3-dihydrobenzofuran-6-yl]acetonitrile CAS Name: 2-[(2R)-2-[(2R)-1-(phenylthio)propan-2-yl]-2,3-dihydrobenzofuran-6-yl]acetonitrile IUPAC Name: 2-[(2R)-2-[(2R)-1-phenylsulfanylpropan-2-yl]-2,3-dihydro-1-benzofuran-6-yl]acetonitrile Traditional Name: 2-[(2R)-2-[(1R)-1-methyl-2-(phenylthio)ethyl]coumaran-6-yl]acetonitrile Formula: C19H19NOS MolecularWeight: 309.42526

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=CC=CC=C1)C2CC3=C(O2)C=C(C=C3)CC#N

Isomeric SMILES

C[C@@H](CSC1=CC=CC=C1)[C@H]2CC3=C(O2)C=C(C=C3)CC#N

InChI

InChI=1S/C19H19NOS/c1-14(13-22-17-5-3-2-4-6-17)18-12-16-8-7-15(9-10-20)11-19(16)21-18/h2-8,11,14,18H,9,12-13H2,1H3/t14-,18+/m0/s1