N-butyl-N-ethyl-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-butyl-N-ethyl-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-butyl-N-ethyl-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-butyl-N-ethyl-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-butyl-N-ethyl-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-butyl-N-ethyl-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C17H25N3O4S MolecularWeight: 367.4631

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCNC(=O)C2

Isomeric SMILES

CCCCN(CC)C(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCNC(=O)C2

InChI

InChI=1S/C17H25N3O4S/c1-3-5-10-19(4-2)17(22)14-7-6-8-15(12-14)25(23,24)20-11-9-18-16(21)13-20/h6-8,12H,3-5,9-11,13H2,1-2H3,(H,18,21)