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

Systemtic Name: N-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-methoxy-phenyl]-4-(1-methylpyrrol-2-yl)benzenesulfonamide Openeye Name: N-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-methoxy-phenyl]-4-(1-methylpyrrol-2-yl)benzenesulfonamide CAS Name: N-[5-[(3R,5S)-3,5-dimethyl-1-piperazinyl]-2-methoxyphenyl]-4-(1-methyl-2-pyrrolyl)benzenesulfonamide IUPAC Name: N-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-methoxyphenyl]-4-(1-methylpyrrol-2-yl)benzenesulfonamide Traditional Name: N-[5-[(3R,5S)-3,5-dimethylpiperazino]-2-methoxy-phenyl]-4-(1-methylpyrrol-2-yl)benzenesulfonamide Formula: C24H30N4O3S MolecularWeight: 454.585

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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=C(C=C3)C4=CC=CN4C

Isomeric SMILES

C[C@@H]1CN(C[C@@H](N1)C)C2=CC(=C(C=C2)OC)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=CN4C

InChI

InChI=1S/C24H30N4O3S/c1-17-15-28(16-18(2)25-17)20-9-12-24(31-4)22(14-20)26-32(29,30)21-10-7-19(8-11-21)23-6-5-13-27(23)3/h5-14,17-18,25-26H,15-16H2,1-4H3/t17-,18+