9-ethyl-2-oxidanyl-3-(phenylmethylsulfanyl)-5,6-dihydrobenzo[h]chromen-4-one

Systemtic Name: 9-ethyl-2-oxidanyl-3-(phenylmethylsulfanyl)-5,6-dihydrobenzo[h]chromen-4-one Openeye Name: 3-benzylsulfanyl-9-ethyl-2-hydroxy-5,6-dihydrobenzo[h]chromen-4-one CAS Name: 9-ethyl-2-hydroxy-3-(phenylmethylthio)-5,6-dihydrobenzo[h][1]benzopyran-4-one IUPAC Name: 3-benzylsulfanyl-9-ethyl-2-hydroxy-5,6-dihydrobenzo[h]chromen-4-one Traditional Name: 3-(benzylthio)-9-ethyl-2-hydroxy-5,6-dihydrobenzo[h]chromen-4-one Formula: C22H20O3S MolecularWeight: 364.4574

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(CCC3=C2OC(=C(C3=O)SCC4=CC=CC=C4)O)C=C1

Isomeric SMILES

CCC1=CC2=C(CCC3=C2OC(=C(C3=O)SCC4=CC=CC=C4)O)C=C1

InChI

InChI=1S/C22H20O3S/c1-2-14-8-9-16-10-11-17-19(23)21(22(24)25-20(17)18(16)12-14)26-13-15-6-4-3-5-7-15/h3-9,12,24H,2,10-11,13H2,1H3