N-ethyl-N-[(3-fluorophenyl)methyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-ethyl-N-[(3-fluorophenyl)methyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-ethyl-N-[(3-fluorophenyl)methyl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-ethyl-N-[(3-fluorophenyl)methyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-ethyl-N-[(3-fluorophenyl)methyl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-ethyl-N-(3-fluorobenzyl)-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C20H22FN3O4S MolecularWeight: 419.469783

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=CC=C1)F)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

Isomeric SMILES

CCN(CC1=CC(=CC=C1)F)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

InChI

InChI=1S/C20H22FN3O4S/c1-2-23(13-15-5-3-7-17(21)11-15)20(26)16-6-4-8-18(12-16)29(27,28)24-10-9-22-19(25)14-24/h3-8,11-12H,2,9-10,13-14H2,1H3,(H,22,25)