2-[4-(2,2-diphenylethanoyl)piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-(2,2-diphenylethanoyl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(2,2-diphenylacetyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-(1-oxo-2,2-diphenylethyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(2,2-diphenylacetyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(2,2-diphenylacetyl)piperazino]sulfonylbenzonitrile Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C25H23N3O3S/c26-19-22-13-7-8-14-23(22)32(30,31)28-17-15-27(16-18-28)25(29)24(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-14,24H,15-18H2