4-(4-cyanophenyl)sulfonyl-N-[2-(2,4-dimethylphenoxy)ethyl]piperazine-1-carboxamide

Systemtic Name: 4-(4-cyanophenyl)sulfonyl-N-[2-(2,4-dimethylphenoxy)ethyl]piperazine-1-carboxamide Openeye Name: 4-(4-cyanophenyl)sulfonyl-N-[2-(2,4-dimethylphenoxy)ethyl]piperazine-1-carboxamide CAS Name: 4-(4-cyanophenyl)sulfonyl-N-[2-(2,4-dimethylphenoxy)ethyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-cyanophenyl)sulfonyl-N-[2-(2,4-dimethylphenoxy)ethyl]piperazine-1-carboxamide Traditional Name: 4-(4-cyanophenyl)sulfonyl-N-[2-(2,4-dimethylphenoxy)ethyl]piperazine-1-carboxamide Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C22H26N4O4S/c1-17-3-8-21(18(2)15-17)30-14-9-24-22(27)25-10-12-26(13-11-25)31(28,29)20-6-4-19(16-23)5-7-20/h3-8,15H,9-14H2,1-2H3,(H,24,27)