(3aR,4R,6aS)-4-tert-butyl-6a-phenylsulfanyl-3a,4-dihydrocyclopenta[b]furan-3,5-dicarbonitrile

Systemtic Name: (3aR,4R,6aS)-4-tert-butyl-6a-phenylsulfanyl-3a,4-dihydrocyclopenta[b]furan-3,5-dicarbonitrile Openeye Name: (3aR,4R,6aS)-4-tert-butyl-6a-phenylsulfanyl-3a,4-dihydrocyclopenta[b]furan-3,5-dicarbonitrile CAS Name: (3aR,4R,6aS)-4-tert-butyl-6a-(phenylthio)-3a,4-dihydrocyclopenta[b]furan-3,5-dicarbonitrile IUPAC Name: (3aR,4R,6aS)-4-tert-butyl-6a-phenylsulfanyl-3a,4-dihydrocyclopenta[b]furan-3,5-dicarbonitrile Traditional Name: (3aR,4R,6aS)-4-tert-butyl-6a-(phenylthio)-3a,4-dihydrocyclopenta[b]furan-3,5-dicarbonitrile Formula: C19H18N2OS MolecularWeight: 322.42402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1C2C(=COC2(C=C1C#N)SC3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)(C)[C@H]1[C@@H]2C(=CO[C@@]2(C=C1C#N)SC3=CC=CC=C3)C#N

InChI

InChI=1S/C19H18N2OS/c1-18(2,3)16-13(10-20)9-19(17(16)14(11-21)12-22-19)23-15-7-5-4-6-8-15/h4-9,12,16-17H,1-3H3/t16-,17+,19+/m1/s1