N-[2-(dimethylamino)-2-phenyl-ethyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[2-(dimethylamino)-2-phenyl-ethyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[2-(dimethylamino)-2-phenyl-ethyl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[2-(dimethylamino)-2-phenylethyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[2-(dimethylamino)-2-phenylethyl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[2-(dimethylamino)-2-phenyl-ethyl]-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCNC(=O)C2)C3=CC=CC=C3

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCNC(=O)C2)C3=CC=CC=C3

InChI

InChI=1S/C21H26N4O4S/c1-24(2)19(16-7-4-3-5-8-16)14-23-21(27)17-9-6-10-18(13-17)30(28,29)25-12-11-22-20(26)15-25/h3-10,13,19H,11-12,14-15H2,1-2H3,(H,22,26)(H,23,27)