4-[4-(2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl)piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-(2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-[2-oxo-1-phenyl-2-(1-piperidyl)ethyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[2-oxo-1-phenyl-2-(1-piperidinyl)ethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-(2-keto-1-phenyl-2-piperidino-ethyl)piperazino]sulfonylbenzonitrile Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H28N4O3S/c25-19-20-9-11-22(12-10-20)32(30,31)28-17-15-26(16-18-28)23(21-7-3-1-4-8-21)24(29)27-13-5-2-6-14-27/h1,3-4,7-12,23H,2,5-6,13-18H2