N-[1-(4-bromophenyl)propyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[1-(4-bromophenyl)propyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[1-(4-bromophenyl)propyl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[1-(4-bromophenyl)propyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[1-(4-bromophenyl)propyl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[1-(4-bromophenyl)propyl]-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C20H22BrN3O4S MolecularWeight: 480.37538

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Br)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

Isomeric SMILES

CCC(C1=CC=C(C=C1)Br)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

InChI

InChI=1S/C20H22BrN3O4S/c1-2-18(14-6-8-16(21)9-7-14)23-20(26)15-4-3-5-17(12-15)29(27,28)24-11-10-22-19(25)13-24/h3-9,12,18H,2,10-11,13H2,1H3,(H,22,25)(H,23,26)