N-(4-butylsulfinylphenyl)-2-piperazin-1-yl-ethanamide

Systemtic Name: N-(4-butylsulfinylphenyl)-2-piperazin-1-yl-ethanamide Openeye Name: N-(4-butylsulfinylphenyl)-2-piperazin-1-yl-acetamide CAS Name: N-(4-butylsulfinylphenyl)-2-(1-piperazinyl)acetamide IUPAC Name: N-(4-butylsulfinylphenyl)-2-piperazin-1-ylacetamide Traditional Name: N-(4-butylsulfinylphenyl)-2-piperazino-acetamide Formula: C16H25N3O2S MolecularWeight: 323.4536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)C1=CC=C(C=C1)NC(=O)CN2CCNCC2

Isomeric SMILES

CCCCS(=O)C1=CC=C(C=C1)NC(=O)CN2CCNCC2

InChI

InChI=1S/C16H25N3O2S/c1-2-3-12-22(21)15-6-4-14(5-7-15)18-16(20)13-19-10-8-17-9-11-19/h4-7,17H,2-3,8-13H2,1H3,(H,18,20)