N,N-diethyl-4-[(S)-[3-(phenylsulfonylamino)phenyl]-piperazin-1-yl-methyl]benzamide

Systemtic Name: N,N-diethyl-4-[(S)-[3-(phenylsulfonylamino)phenyl]-piperazin-1-yl-methyl]benzamide Openeye Name: 4-[(S)-[3-(benzenesulfonamido)phenyl]-piperazin-1-yl-methyl]-N,N-diethyl-benzamide CAS Name: 4-[(S)-[3-(benzenesulfonamido)phenyl]-(1-piperazinyl)methyl]-N,N-diethylbenzamide IUPAC Name: 4-[(S)-[3-(benzenesulfonamido)phenyl]-piperazin-1-ylmethyl]-N,N-diethylbenzamide Traditional Name: 4-[(S)-[3-(benzenesulfonamido)phenyl]-piperazino-methyl]-N,N-diethyl-benzamide Formula: C28H34N4O3S MolecularWeight: 506.65956

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC=C3)N4CCNCC4

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)[C@@H](C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC=C3)N4CCNCC4

InChI

InChI=1S/C28H34N4O3S/c1-3-31(4-2)28(33)23-15-13-22(14-16-23)27(32-19-17-29-18-20-32)24-9-8-10-25(21-24)30-36(34,35)26-11-6-5-7-12-26/h5-16,21,27,29-30H,3-4,17-20H2,1-2H3/t27-/m0/s1