4-(4-cyanophenyl)-N-[(2-methoxyphenyl)methyl]-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzenesulfonamide

Systemtic Name: 4-(4-cyanophenyl)-N-[(2-methoxyphenyl)methyl]-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzenesulfonamide Openeye Name: 4-(4-cyanophenyl)-N-[(2-methoxyphenyl)methyl]-N-(2-oxo-2-piperazin-1-yl-ethyl)benzenesulfonamide CAS Name: 4-(4-cyanophenyl)-N-[(2-methoxyphenyl)methyl]-N-[2-oxo-2-(1-piperazinyl)ethyl]benzenesulfonamide IUPAC Name: 4-(4-cyanophenyl)-N-[(2-methoxyphenyl)methyl]-N-(2-oxo-2-piperazin-1-ylethyl)benzenesulfonamide Traditional Name: 4-(4-cyanophenyl)-N-(2-keto-2-piperazino-ethyl)-N-o-anisyl-benzenesulfonamide Formula: C27H28N4O4S MolecularWeight: 504.60062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN(CC(=O)N2CCNCC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

COC1=CC=CC=C1CN(CC(=O)N2CCNCC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C27H28N4O4S/c1-35-26-5-3-2-4-24(26)19-31(20-27(32)30-16-14-29-15-17-30)36(33,34)25-12-10-23(11-13-25)22-8-6-21(18-28)7-9-22/h2-13,29H,14-17,19-20H2,1H3