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

Systemtic Name: N-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-methoxy-phenyl]-5-pyridin-2-yl-thiophene-2-sulfonamide Openeye Name: N-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-methoxy-phenyl]-5-(2-pyridyl)thiophene-2-sulfonamide CAS Name: N-[5-[(3R,5S)-3,5-dimethyl-1-piperazinyl]-2-methoxyphenyl]-5-(2-pyridinyl)-2-thiophenesulfonamide IUPAC Name: N-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-methoxyphenyl]-5-pyridin-2-ylthiophene-2-sulfonamide Traditional Name: N-[5-[(3R,5S)-3,5-dimethylpiperazino]-2-methoxy-phenyl]-5-(2-pyridyl)thiophene-2-sulfonamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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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(S3)C4=CC=CC=N4

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O3S2/c1-15-13-26(14-16(2)24-15)17-7-8-20(29-3)19(12-17)25-31(27,28)22-10-9-21(30-22)18-6-4-5-11-23-18/h4-12,15-16,24-25H,13-14H2,1-3H3/t15-,16+