2-[3-(4-methylpiperazin-1-yl)propyl]-6-oxidanyl-2-phenyl-5-(2-propan-2-ylphenyl)sulfanyl-3H-pyran-4-one

Systemtic Name: 2-[3-(4-methylpiperazin-1-yl)propyl]-6-oxidanyl-2-phenyl-5-(2-propan-2-ylphenyl)sulfanyl-3H-pyran-4-one Openeye Name: 6-hydroxy-5-(2-isopropylphenyl)sulfanyl-2-[3-(4-methylpiperazin-1-yl)propyl]-2-phenyl-3H-pyran-4-one CAS Name: 6-hydroxy-2-[3-(4-methyl-1-piperazinyl)propyl]-2-phenyl-5-[(2-propan-2-ylphenyl)thio]-3H-pyran-4-one IUPAC Name: 6-hydroxy-2-[3-(4-methylpiperazin-1-yl)propyl]-2-phenyl-5-(2-propan-2-ylphenyl)sulfanyl-3H-pyran-4-one Traditional Name: 6-hydroxy-2-[3-(4-methylpiperazino)propyl]-5-(o-cumenylthio)-2-phenyl-3H-pyran-4-one Formula: C28H36N2O3S MolecularWeight: 480.66204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(OC(CC2=O)(CCCN3CCN(CC3)C)C4=CC=CC=C4)O

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(OC(CC2=O)(CCCN3CCN(CC3)C)C4=CC=CC=C4)O

InChI

InChI=1S/C28H36N2O3S/c1-21(2)23-12-7-8-13-25(23)34-26-24(31)20-28(33-27(26)32,22-10-5-4-6-11-22)14-9-15-30-18-16-29(3)17-19-30/h4-8,10-13,21,32H,9,14-20H2,1-3H3