N-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-methoxy-phenyl]-3-(furan-2-yl)benzenesulfonamide

Systemtic Name: N-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-methoxy-phenyl]-3-(furan-2-yl)benzenesulfonamide Openeye Name: N-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-methoxy-phenyl]-3-(2-furyl)benzenesulfonamide CAS Name: N-[5-[(3R,5S)-3,5-dimethyl-1-piperazinyl]-2-methoxyphenyl]-3-(2-furanyl)benzenesulfonamide IUPAC Name: N-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-methoxyphenyl]-3-(furan-2-yl)benzenesulfonamide Traditional Name: N-[5-[(3R,5S)-3,5-dimethylpiperazino]-2-methoxy-phenyl]-3-(2-furyl)benzenesulfonamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=CC(=C(C=C2)OC)NS(=O)(=O)C3=CC=CC(=C3)C4=CC=CO4

Isomeric SMILES

C[C@@H]1CN(C[C@@H](N1)C)C2=CC(=C(C=C2)OC)NS(=O)(=O)C3=CC=CC(=C3)C4=CC=CO4

InChI

InChI=1S/C23H27N3O4S/c1-16-14-26(15-17(2)24-16)19-9-10-23(29-3)21(13-19)25-31(27,28)20-7-4-6-18(12-20)22-8-5-11-30-22/h4-13,16-17,24-25H,14-15H2,1-3H3/t16-,17+