2-[2-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]carbonylphenyl]sulfanyl-N-(2-methoxyethyl)ethanamide

Systemtic Name: 2-[2-[4-(3-fluorophenyl)carbonylpiperazin-1-yl]carbonylphenyl]sulfanyl-N-(2-methoxyethyl)ethanamide Openeye Name: 2-[2-[4-(3-fluorobenzoyl)piperazine-1-carbonyl]phenyl]sulfanyl-N-(2-methoxyethyl)acetamide CAS Name: 2-[[2-[[4-[(3-fluorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]phenyl]thio]-N-(2-methoxyethyl)acetamide IUPAC Name: 2-[2-[4-(3-fluorobenzoyl)piperazine-1-carbonyl]phenyl]sulfanyl-N-(2-methoxyethyl)acetamide Traditional Name: 2-[[2-[4-(3-fluorobenzoyl)piperazine-1-carbonyl]phenyl]thio]-N-(2-methoxyethyl)acetamide Formula: C23H26FN3O4S MolecularWeight: 459.533643

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)CSC1=CC=CC=C1C(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

COCCNC(=O)CSC1=CC=CC=C1C(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C23H26FN3O4S/c1-31-14-9-25-21(28)16-32-20-8-3-2-7-19(20)23(30)27-12-10-26(11-13-27)22(29)17-5-4-6-18(24)15-17/h2-8,15H,9-14,16H2,1H3,(H,25,28)