N-[3-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-4-methoxy-phenyl]-3-methyl-4-thiophen-2-yl-benzenesulfonamide

Systemtic Name: N-[3-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-4-methoxy-phenyl]-3-methyl-4-thiophen-2-yl-benzenesulfonamide Openeye Name: N-[3-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-4-methoxy-phenyl]-3-methyl-4-(2-thienyl)benzenesulfonamide CAS Name: N-[3-[(3R,5S)-3,5-dimethyl-1-piperazinyl]-4-methoxyphenyl]-3-methyl-4-thiophen-2-ylbenzenesulfonamide IUPAC Name: N-[3-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-4-methoxyphenyl]-3-methyl-4-thiophen-2-ylbenzenesulfonamide Traditional Name: N-[3-[(3R,5S)-3,5-dimethylpiperazino]-4-methoxy-phenyl]-3-methyl-4-(2-thienyl)benzenesulfonamide Formula: C24H29N3O3S2 MolecularWeight: 471.63536

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)C4=CC=CS4)C)OC

Isomeric SMILES

C[C@@H]1CN(C[C@@H](N1)C)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)C4=CC=CS4)C)OC

InChI

InChI=1S/C24H29N3O3S2/c1-16-12-20(8-9-21(16)24-6-5-11-31-24)32(28,29)26-19-7-10-23(30-4)22(13-19)27-14-17(2)25-18(3)15-27/h5-13,17-18,25-26H,14-15H2,1-4H3/t17-,18+