1-phenyl-2-phenylsulfanyl-2-(4,5,6,7-tetrahydro-2-benzofuran-1-yl)pent-4-en-1-one

Systemtic Name: 1-phenyl-2-phenylsulfanyl-2-(4,5,6,7-tetrahydro-2-benzofuran-1-yl)pent-4-en-1-one Openeye Name: 1-phenyl-2-phenylsulfanyl-2-(4,5,6,7-tetrahydroisobenzofuran-1-yl)pent-4-en-1-one CAS Name: 1-phenyl-2-(phenylthio)-2-(4,5,6,7-tetrahydroisobenzofuran-1-yl)-4-penten-1-one IUPAC Name: 1-phenyl-2-phenylsulfanyl-2-(4,5,6,7-tetrahydro-2-benzofuran-1-yl)pent-4-en-1-one Traditional Name: 1-phenyl-2-(phenylthio)-2-(4,5,6,7-tetrahydroisobenzofuran-1-yl)pent-4-en-1-one Formula: C25H24O2S MolecularWeight: 388.52186

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C1=C2CCCCC2=CO1)(C(=O)C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C=CCC(C1=C2CCCCC2=CO1)(C(=O)C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C25H24O2S/c1-2-17-25(28-21-14-7-4-8-15-21,23(26)19-11-5-3-6-12-19)24-22-16-10-9-13-20(22)18-27-24/h2-8,11-12,14-15,18H,1,9-10,13,16-17H2