N-[3-[ethyl(phenyl)amino]propyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[3-[ethyl(phenyl)amino]propyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[3-(N-ethylanilino)propyl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[3-(N-ethylanilino)propyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[3-(N-ethylanilino)propyl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[3-(N-ethylanilino)propyl]-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCNC(=O)C2)C3=CC=CC=C3

Isomeric SMILES

CCN(CCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCNC(=O)C2)C3=CC=CC=C3

InChI

InChI=1S/C22H28N4O4S/c1-2-25(19-9-4-3-5-10-19)14-7-12-24-22(28)18-8-6-11-20(16-18)31(29,30)26-15-13-23-21(27)17-26/h3-6,8-11,16H,2,7,12-15,17H2,1H3,(H,23,27)(H,24,28)