5-chloranyl-4,7-dimethyl-2-(phenylsulfanylmethyl)-2,3-dihydro-1-benzofuran

Systemtic Name: 5-chloranyl-4,7-dimethyl-2-(phenylsulfanylmethyl)-2,3-dihydro-1-benzofuran Openeye Name: 5-chloro-4,7-dimethyl-2-(phenylsulfanylmethyl)-2,3-dihydrobenzofuran CAS Name: 5-chloro-4,7-dimethyl-2-[(phenylthio)methyl]-2,3-dihydrobenzofuran IUPAC Name: 5-chloro-4,7-dimethyl-2-(phenylsulfanylmethyl)-2,3-dihydro-1-benzofuran Traditional Name: 5-chloro-4,7-dimethyl-2-[(phenylthio)methyl]coumaran Formula: C17H17ClOS MolecularWeight: 304.83428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1OC(C2)CSC3=CC=CC=C3)C)Cl

Isomeric SMILES

CC1=CC(=C(C2=C1OC(C2)CSC3=CC=CC=C3)C)Cl

InChI

InChI=1S/C17H17ClOS/c1-11-8-16(18)12(2)15-9-13(19-17(11)15)10-20-14-6-4-3-5-7-14/h3-8,13H,9-10H2,1-2H3