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

Systemtic Name: 6-[4-[2-(2-methylpiperazin-1-yl)ethoxy]phenyl]-2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one Openeye Name: 2-hydroxy-3-(2-isopropylphenyl)sulfanyl-6-[4-[2-(2-methylpiperazin-1-yl)ethoxy]phenyl]pyran-4-one CAS Name: 2-hydroxy-6-[4-[2-(2-methyl-1-piperazinyl)ethoxy]phenyl]-3-[(2-propan-2-ylphenyl)thio]-4-pyranone IUPAC Name: 2-hydroxy-6-[4-[2-(2-methylpiperazin-1-yl)ethoxy]phenyl]-3-(2-propan-2-ylphenyl)sulfanylpyran-4-one Traditional Name: 2-hydroxy-6-[4-[2-(2-methylpiperazino)ethoxy]phenyl]-3-(o-cumenylthio)pyran-4-one Formula: C27H32N2O4S MolecularWeight: 480.61898

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCN1CCOC2=CC=C(C=C2)C3=CC(=O)C(=C(O3)O)SC4=CC=CC=C4C(C)C

Isomeric SMILES

CC1CNCCN1CCOC2=CC=C(C=C2)C3=CC(=O)C(=C(O3)O)SC4=CC=CC=C4C(C)C

InChI

InChI=1S/C27H32N2O4S/c1-18(2)22-6-4-5-7-25(22)34-26-23(30)16-24(33-27(26)31)20-8-10-21(11-9-20)32-15-14-29-13-12-28-17-19(29)3/h4-11,16,18-19,28,31H,12-15,17H2,1-3H3