4-[[4-(4-ethenylphenyl)sulfonyl-2-oxidanylidene-piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(4-ethenylphenyl)sulfonyl-2-oxidanylidene-piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[2-oxo-4-(4-vinylphenyl)sulfonyl-piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-(4-ethenylphenyl)sulfonyl-2-oxo-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(4-ethenylphenyl)sulfonyl-2-oxopiperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[2-keto-4-(4-vinylphenyl)sulfonyl-piperazino]methyl]benzonitrile Formula: C20H19N3O3S MolecularWeight: 381.44816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C(=O)C2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

C=CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C(=O)C2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H19N3O3S/c1-2-16-7-9-19(10-8-16)27(25,26)23-12-11-22(20(24)15-23)14-18-5-3-17(13-21)4-6-18/h2-10H,1,11-12,14-15H2