N-[3-[(3R,5S)-3,5-dimethylpiperazin-1-yl]phenyl]-5-pyridin-2-yl-thiophene-2-sulfonamide

Systemtic Name: N-[3-[(3R,5S)-3,5-dimethylpiperazin-1-yl]phenyl]-5-pyridin-2-yl-thiophene-2-sulfonamide Openeye Name: N-[3-[(3R,5S)-3,5-dimethylpiperazin-1-yl]phenyl]-5-(2-pyridyl)thiophene-2-sulfonamide CAS Name: N-[3-[(3R,5S)-3,5-dimethyl-1-piperazinyl]phenyl]-5-(2-pyridinyl)-2-thiophenesulfonamide IUPAC Name: N-[3-[(3R,5S)-3,5-dimethylpiperazin-1-yl]phenyl]-5-pyridin-2-ylthiophene-2-sulfonamide Traditional Name: N-[3-[(3R,5S)-3,5-dimethylpiperazino]phenyl]-5-(2-pyridyl)thiophene-2-sulfonamide Formula: C21H24N4O2S2 MolecularWeight: 428.57086

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(S3)C4=CC=CC=N4

Isomeric SMILES

C[C@@H]1CN(C[C@@H](N1)C)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(S3)C4=CC=CC=N4

InChI

InChI=1S/C21H24N4O2S2/c1-15-13-25(14-16(2)23-15)18-7-5-6-17(12-18)24-29(26,27)21-10-9-20(28-21)19-8-3-4-11-22-19/h3-12,15-16,23-24H,13-14H2,1-2H3/t15-,16+