[4-[2-(oxolan-2-ylmethylsulfanyl)phenyl]carbonylpiperazin-1-yl]-(4-propan-2-ylphenyl)methanone

Systemtic Name: [4-[2-(oxolan-2-ylmethylsulfanyl)phenyl]carbonylpiperazin-1-yl]-(4-propan-2-ylphenyl)methanone Openeye Name: (4-isopropylphenyl)-[4-[2-(tetrahydrofuran-2-ylmethylsulfanyl)benzoyl]piperazin-1-yl]methanone CAS Name: [4-[oxo-[2-(2-oxolanylmethylthio)phenyl]methyl]-1-piperazinyl]-(4-propan-2-ylphenyl)methanone IUPAC Name: [4-[2-(oxolan-2-ylmethylsulfanyl)benzoyl]piperazin-1-yl]-(4-propan-2-ylphenyl)methanone Traditional Name: p-cumenyl-[4-[2-(tetrahydrofurfurylthio)benzoyl]piperazino]methanone Formula: C26H32N2O3S MolecularWeight: 452.60888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3SCC4CCCO4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3SCC4CCCO4

InChI

InChI=1S/C26H32N2O3S/c1-19(2)20-9-11-21(12-10-20)25(29)27-13-15-28(16-14-27)26(30)23-7-3-4-8-24(23)32-18-22-6-5-17-31-22/h3-4,7-12,19,22H,5-6,13-18H2,1-2H3