3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-(4-propan-2-ylphenyl)benzamide

Systemtic Name: 3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-(4-propan-2-ylphenyl)benzamide Openeye Name: N-(4-isopropylphenyl)-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: 3-[(3-oxo-1-piperazinyl)sulfonyl]-N-(4-propan-2-ylphenyl)benzamide IUPAC Name: 3-(3-oxopiperazin-1-yl)sulfonyl-N-(4-propan-2-ylphenyl)benzamide Traditional Name: 3-(3-ketopiperazino)sulfonyl-N-p-cumenyl-benzamide Formula: C20H23N3O4S MolecularWeight: 401.47932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O4S/c1-14(2)15-6-8-17(9-7-15)22-20(25)16-4-3-5-18(12-16)28(26,27)23-11-10-21-19(24)13-23/h3-9,12,14H,10-11,13H2,1-2H3,(H,21,24)(H,22,25)