3-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2,2-dimethyl-3-oxidanylidene-propanenitrile

Systemtic Name: 3-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2,2-dimethyl-3-oxidanylidene-propanenitrile Openeye Name: 3-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2,2-dimethyl-3-oxo-propanenitrile CAS Name: 3-[4-(2-chlorophenyl)sulfonyl-1-piperazinyl]-2,2-dimethyl-3-oxopropanenitrile IUPAC Name: 3-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2,2-dimethyl-3-oxopropanenitrile Traditional Name: 3-[4-(2-chlorophenyl)sulfonylpiperazino]-3-keto-2,2-dimethyl-propionitrile Formula: C15H18ClN3O3S MolecularWeight: 355.83972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC(C)(C#N)C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C15H18ClN3O3S/c1-15(2,11-17)14(20)18-7-9-19(10-8-18)23(21,22)13-6-4-3-5-12(13)16/h3-6H,7-10H2,1-2H3