4-[4-(3-oxidanylidenepiperazin-1-yl)carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-(3-oxidanylidenepiperazin-1-yl)carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[[4-(3-oxopiperazine-1-carbonyl)-1-piperidyl]sulfonyl]benzonitrile CAS Name: 4-[[4-[oxo-(3-oxo-1-piperazinyl)methyl]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(3-oxopiperazine-1-carbonyl)piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-(3-ketopiperazine-1-carbonyl)piperidino]sulfonylbenzonitrile Formula: C17H20N4O4S MolecularWeight: 376.4301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCNC(=O)C2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCC1C(=O)N2CCNC(=O)C2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H20N4O4S/c18-11-13-1-3-15(4-2-13)26(24,25)21-8-5-14(6-9-21)17(23)20-10-7-19-16(22)12-20/h1-4,14H,5-10,12H2,(H,19,22)