2-[[methyl(phenyl)amino]methyl]-6-oxidanyl-5-phenethylsulfanyl-2-phenyl-3H-pyran-4-one

Systemtic Name: 2-[[methyl(phenyl)amino]methyl]-6-oxidanyl-5-phenethylsulfanyl-2-phenyl-3H-pyran-4-one Openeye Name: 6-hydroxy-2-[(N-methylanilino)methyl]-5-phenethylsulfanyl-2-phenyl-3H-pyran-4-one CAS Name: 6-hydroxy-2-[(N-methylanilino)methyl]-5-(phenethylthio)-2-phenyl-3H-pyran-4-one IUPAC Name: 6-hydroxy-2-[(N-methylanilino)methyl]-5-phenethylsulfanyl-2-phenyl-3H-pyran-4-one Traditional Name: 6-hydroxy-2-[(N-methylanilino)methyl]-5-(phenethylthio)-2-phenyl-3H-pyran-4-one Formula: C27H27NO3S MolecularWeight: 445.57318

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1(CC(=O)C(=C(O1)O)SCCC2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(CC1(CC(=O)C(=C(O1)O)SCCC2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H27NO3S/c1-28(23-15-9-4-10-16-23)20-27(22-13-7-3-8-14-22)19-24(29)25(26(30)31-27)32-18-17-21-11-5-2-6-12-21/h2-16,30H,17-20H2,1H3