2-[2-[4-[2-(2-acetamidophenyl)sulfanylphenyl]carbonylpiperazin-1-yl]ethoxy]ethyl ethanoate

Systemtic Name: 2-[2-[4-[2-(2-acetamidophenyl)sulfanylphenyl]carbonylpiperazin-1-yl]ethoxy]ethyl ethanoate Openeye Name: 2-[2-[4-[2-(2-acetamidophenyl)sulfanylbenzoyl]piperazin-1-yl]ethoxy]ethyl acetate CAS Name: acetic acid 2-[2-[4-[[2-[(2-acetamidophenyl)thio]phenyl]-oxomethyl]-1-piperazinyl]ethoxy]ethyl ester IUPAC Name: 2-[2-[4-[2-(2-acetamidophenyl)sulfanylbenzoyl]piperazin-1-yl]ethoxy]ethyl acetate Traditional Name: acetic acid 2-[2-[4-[2-[(2-acetamidophenyl)thio]benzoyl]piperazino]ethoxy]ethyl ester Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1SC2=CC=CC=C2C(=O)N3CCN(CC3)CCOCCOC(=O)C

Isomeric SMILES

CC(=O)NC1=CC=CC=C1SC2=CC=CC=C2C(=O)N3CCN(CC3)CCOCCOC(=O)C

InChI

InChI=1S/C25H31N3O5S/c1-19(29)26-22-8-4-6-10-24(22)34-23-9-5-3-7-21(23)25(31)28-13-11-27(12-14-28)15-16-32-17-18-33-20(2)30/h3-10H,11-18H2,1-2H3,(H,26,29)