2-oxidanyl-6-[4-(2-piperazin-1-ylethoxy)phenyl]-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one

Systemtic Name: 2-oxidanyl-6-[4-(2-piperazin-1-ylethoxy)phenyl]-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one Openeye Name: 2-hydroxy-3-(2-isopropylphenyl)sulfanyl-6-[4-(2-piperazin-1-ylethoxy)phenyl]pyran-4-one CAS Name: 2-hydroxy-6-[4-[2-(1-piperazinyl)ethoxy]phenyl]-3-[(2-propan-2-ylphenyl)thio]-4-pyranone IUPAC Name: 2-hydroxy-6-[4-(2-piperazin-1-ylethoxy)phenyl]-3-(2-propan-2-ylphenyl)sulfanylpyran-4-one Traditional Name: 2-hydroxy-3-(o-cumenylthio)-6-[4-(2-piperazinoethoxy)phenyl]pyran-4-one Formula: C26H30N2O4S MolecularWeight: 466.5924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3=CC=C(C=C3)OCCN4CCNCC4)O

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3=CC=C(C=C3)OCCN4CCNCC4)O

InChI

InChI=1S/C26H30N2O4S/c1-18(2)21-5-3-4-6-24(21)33-25-22(29)17-23(32-26(25)30)19-7-9-20(10-8-19)31-16-15-28-13-11-27-12-14-28/h3-10,17-18,27,30H,11-16H2,1-2H3