1-(5-bromanylthiophen-2-yl)sulfonyl-N-(3,5-dimethoxyphenyl)piperidine-3-carboxamide

Systemtic Name: 1-(5-bromanylthiophen-2-yl)sulfonyl-N-(3,5-dimethoxyphenyl)piperidine-3-carboxamide Openeye Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(3,5-dimethoxyphenyl)piperidine-3-carboxamide CAS Name: 1-[(5-bromo-2-thiophenyl)sulfonyl]-N-(3,5-dimethoxyphenyl)-3-piperidinecarboxamide IUPAC Name: 1-(5-bromothiophen-2-yl)sulfonyl-N-(3,5-dimethoxyphenyl)piperidine-3-carboxamide Traditional Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(3,5-dimethoxyphenyl)nipecotamide Formula: C18H21BrN2O5S2 MolecularWeight: 489.40374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Br)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Br)OC

InChI

InChI=1S/C18H21BrN2O5S2/c1-25-14-8-13(9-15(10-14)26-2)20-18(22)12-4-3-7-21(11-12)28(23,24)17-6-5-16(19)27-17/h5-6,8-10,12H,3-4,7,11H2,1-2H3,(H,20,22)